SCHEMBL1967273

SCHEMBL1967273

O=C(O)N1CCCCC1CCO

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.47
POLB P06746 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NAMPT P43490 1/20 0.42
ADORA2A P29274 2/20 0.40
ADORA2B P29275 2/20 0.40
ADORA3 P0DMS8 1/20 0.40
ADORA1 P30542 1/20 0.40
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
VNN1 O95497 1/20 0.40
NPC1 O15118 1/20 0.38
TP53 P04637 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4968512 1.00 AKR1C3 (0.47) AKR1C3POLBL3MBTL1NAMPTADORA2A
SCHEMBL20590901 1.00 AKR1C3 (0.47) AKR1C3POLBL3MBTL1NAMPTADORA2A
SCHEMBL17395384 0.98 AKR1C3 (0.46) AKR1C3POLBL3MBTL1NAMPTADORA2A
SCHEMBL2462769 0.94 POLB (0.52) AKR1C3POLBL3MBTL1NAMPTADORA2A
SCHEMBL3832124 0.94 POLB (0.52) AKR1C3POLBL3MBTL1NAMPTADORA2A
SCHEMBL4969300 0.94 POLB (0.52) AKR1C3POLBL3MBTL1NAMPTADORA2A
SCHEMBL27877522 0.92 AKR1C3 (0.42) AKR1C3POLBL3MBTL1NAMPTADORA2A
SCHEMBL1081925 0.89 POLB (0.43) AKR1C3POLBL3MBTL1NAMPTADORA2A
SCHEMBL3996597 0.89 POLB (0.43) AKR1C3POLBL3MBTL1NAMPTADORA2A
SCHEMBL22608706 0.89 AKR1C3 (0.41) AKR1C3POLBL3MBTL1NAMPTADORA2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 78 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3763212-B1 ARTHROPODA REPELLENT COMPOSITION SANDERSTROTHMANN GMBH (DE) 2021-08-18 EP claimed
CN-104621099-B A kind of preparation method of mosquito repellent preserved flower Yuan Hong bio tech ltd, Ningbo (CN) 2016-05-04 CN claimed
US-9301527-B2 Insect repellent composition DAKEM (FR) 2016-04-05 US claimed
EP-2018102-B1 TOPICAL INSECT REPELLENT COMPOSITION AND METHOD OF APPLICATION 3M INNOVATIVE PROPERTIES CO (US) 2016-01-27 EP claimed
US-20150342187-A1 Insect Repellent Composition DAKEM (FR) 2015-12-03 US claimed
EP-2405753-B1 INSECT-REPELLENT COMPOSITION DAKEM (FR) 2013-10-02 EP claimed
CN-102167681-B Method for preparing insect repellant icaridin CHANGZHOU PHARMACEUTICAL INST 2012-10-24 CN claimed
CN-101698658-B Method for preparing wormer sec-Butyl 2-(2-hydroxyethyl)piperidine-1-carboxylate CHANGTING JINMEI BIOTECHNOLOGY CO LTD 2012-06-13 CN claimed
CN-102167681-A Method for preparing insect repellant icaridin CHANGZHOU PHARMACEUTICAL INST 2011-08-31 CN claimed
WO-2010103478-A1 INSECT REPELLENT COMPOSITION DAKEM (FR) 2010-09-16 WO claimed
CN-101698658-A Method for preparing wormer sec-Butyl 2-(2-hydroxyethyl)piperidine-1-carboxylate XIAMEN SUMMIT BIOTECHNOLOGY CO 2010-04-28 CN claimed
EP-1087951-B9 CARBON SUBSTITUTED AMINOTHIAZOLE INHIBITORS OF CYCLIN DEPENDENT KINASES BRISTOL MYERS SQUIBB CO (US) 2006-09-13 EP claimed
EP-1139735-B1 METHOD AND APPARATUS FOR DISPERSING A VOLATILE COMPOSITION UNIV SOUTHAMPTON (GB) 2006-07-12 EP claimed
EP-1087951-B1 CARBON SUBSTITUTED AMINOTHIAZOLE INHIBITORS OF CYCLIN DEPENDENT KINASES BRISTOL MYERS SQUIBB CO (US) 2005-02-09 EP claimed
EP-0792581-B1 Insect controller SUMITOMO CHEMICAL CO (JP) 2004-12-01 EP claimed
US-20020165259-A1 Carbon substituted aminothiazole inhibitors of cyclin dependent kinases RAWLINS DAVID B (US) 2002-11-07 US claimed
EP-1087951-A4 CARBON SUBSTITUTED AMINOTHIAZOLE INHIBITORS OF CYCLIN DEPENDENT KINASES BRISTOL MYERS SQUIBB CO (US) 2002-08-14 EP claimed
EP-1087951-A1 CARBON SUBSTITUTED AMINOTHIAZOLE INHIBITORS OF CYCLIN DEPENDENT KINASES BRISTOL-MYERS SQUIBB COMPANY (US) 2001-04-04 EP claimed
WO-1999065884-A1 CARBON SUBSTITUTED AMINOTHIAZOLE INHIBITORS OF CYCLIN DEPENDENT KINASES BRISTOL-MYERS SQUIBB COMPANY (US) 1999-12-23 WO claimed
EP-4415824-A1 QUINOLINE COMPOUNDS AS INHIBITORS OF KRAS Incyte Corporation (US) 2024-08-21 EP disclosed
US-20240025868-A1 PHENOTHIAZINE COMPOUNDS FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND OTHER AGE-RELATED AND NEUROLOGICAL DISEASES ICAHN SCHOOL MED MOUNT SINAI (US) 2024-01-25 US disclosed
CN-117337292-A Pyridine derivatives having N-linked cyclic substituents as cGAS inhibitors 勃林格殷格翰国际有限公司 2024-01-02 CN disclosed
WO-2023119325-A1 MOLECULAR IODINE AND CITRONELLA OIL BASED FORMULATION, AND ITS APPLICATION AS MOSQUITO REPELLENT KEJRIWAL ANIL (IN) 2023-06-29 WO disclosed
WO-2023064857-A1 QUINOLINE COMPOUNDS AS INHIBITORS OF KRAS INCYTE CORPORATION (US) 2023-04-20 WO disclosed
WO-2022161414-A1 AROMATIC COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND APPLICATION THEREOF 成都茵创园医药科技有限公司 2022-08-04 WO disclosed
US-20200323212-A1 PEST CONTROL COMPOSITION AND USE OF SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-10-15 US disclosed
WO-2020137775-A1 PEST REPELLENT COMPOSITION 花王株式会社 2020-07-02 WO disclosed
WO-2020137771-A1 OIL-IN-WATER TYPE PEST REPELLENT COMPOSITION 花王株式会社 2020-07-02 WO disclosed
WO-2020137774-A1 PEST REPELLENT COMPOSITION 花王株式会社 2020-07-02 WO disclosed
WO-2019160114-A1 ARTICLE FOR TREATMENT OF FIBER PRODUCT AND FIBER PRODUCT TREATMENT AGENT COMPOSITION ライオン株式会社 2019-08-22 WO disclosed
US-20180271771-A1 POLYURETHANEUREA SOLUTIONS FOR COMPOSITIONS WITH ACTIVE INGREDIENTS OR FRAGRANCES COVESTRO DEUTSCHLAND AG (DE) 2018-09-27 US disclosed
CN-107963834-A A kind of ornament materials and preparation method thereof 柳州市郊区和平第五砖厂 2018-04-27 CN disclosed
CN-107935521-A A kind of mosquito repellent porous brick and preparation method thereof 柳州市闽贵砖厂 2018-04-20 CN disclosed
CN-107840644-A A kind of mosquito repellent floor tile and preparation method thereof 柳州市闽贵砖厂 2018-03-27 CN disclosed
EP-3247325-A1 POLYURETHANEUREA SOLUTIONS FOR COMPOSITIONS WITH ACTIVE INGREDIENTS OR FRAGRANCES Covestro Deutschland AG (DE) 2017-11-29 EP disclosed
WO-2017171030-A1 SPRAY PRODUCT AND SPRAY METHOD アース製薬株式会社 2017-10-05 WO disclosed
CN-106726912-A The preparation method of antipruritic mosquito-driving liquid and antipruritic mosquito-driving liquid 东莞小猕猴户外用品有限公司 2017-05-31 CN disclosed
CN-106580776-A Preparation method of long-acting mosquito repellent liquid and long-acting mosquito repellent liquid 东莞小猕猴户外用品有限公司 2017-04-26 CN disclosed
WO-2016116403-A1 POLYURETHANEUREA SOLUTIONS FOR COMPOSITIONS WITH ACTIVE INGREDIENTS OR FRAGRANCES COVESTRO DEUTSCHLAND AG (DE) 2016-07-28 WO disclosed
CN-104621099-B A kind of preparation method of mosquito repellent preserved flower Yuan Hong bio tech ltd, Ningbo (CN) 2016-05-04 CN disclosed
US-9301527-B2 Insect repellent composition DAKEM (FR) 2016-04-05 US disclosed
US-9301527-B2 Insect repellent composition DAKEM (FR) 2016-04-05 US disclosed
US-20150342187-A1 Insect Repellent Composition DAKEM (FR) 2015-12-03 US disclosed
US-20150342187-A1 Insect Repellent Composition DAKEM (FR) 2015-12-03 US disclosed
CN-103751790-A Dermal film-forming liquid formulations for drug release to skin POLICHEM SA 2014-04-30 CN disclosed
WO-2014031790-A1 NOOTKATONE AS AN INSECTICIDE AND INSECT REPELLENT ALLYLIX, INC. (US) 2014-02-27 WO disclosed
EP-2675787-A1 AMINOINDANE COMPOUNDS AND USE THEREOF IN TREATING PAIN Endo Pharmaceuticals Inc. (US) 2013-12-25 EP disclosed
EP-2405753-B1 INSECT-REPELLENT COMPOSITION DAKEM (FR) 2013-10-02 EP disclosed
EP-2640699-A2 BRIDGED SPIRO[2.4]HEPTANE ESTER DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2013-09-25 EP disclosed
CN-102167681-B Method for preparing insect repellant icaridin CHANGZHOU PHARMACEUTICAL INST 2012-10-24 CN disclosed
WO-2012112969-A1 AMINOINDANE COMPOUNDS AND USE THEREOF IN TREATING PAIN ENDO PHARMACEUTICALS INC. (US) 2012-08-23 WO disclosed
CN-101698658-B Method for preparing wormer sec-Butyl 2-(2-hydroxyethyl)piperidine-1-carboxylate CHANGTING JINMEI BIOTECHNOLOGY CO LTD 2012-06-13 CN disclosed
CN-101698658-B Method for preparing wormer sec-Butyl 2-(2-hydroxyethyl)piperidine-1-carboxylate CHANGTING JINMEI BIOTECHNOLOGY CO LTD 2012-06-13 CN disclosed
CN-101698658-B Method for preparing wormer sec-Butyl 2-(2-hydroxyethyl)piperidine-1-carboxylate CHANGTING JINMEI BIOTECHNOLOGY CO LTD 2012-06-13 CN disclosed
WO-2012066488-A2 BRIDGED SPIRO[2.4]HEPTANE ESTER DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2012-05-24 WO disclosed
CN-102167681-A Method for preparing insect repellant icaridin CHANGZHOU PHARMACEUTICAL INST 2011-08-31 CN disclosed
EP-2334677-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS Array Biopharma, Inc. (US) 2011-06-22 EP disclosed
WO-2010103478-A1 INSECT REPELLENT COMPOSITION DAKEM (FR) 2010-09-16 WO disclosed
CN-101698658-A Method for preparing wormer sec-Butyl 2-(2-hydroxyethyl)piperidine-1-carboxylate XIAMEN SUMMIT BIOTECHNOLOGY CO 2010-04-28 CN disclosed
CN-101698658-A Method for preparing wormer sec-Butyl 2-(2-hydroxyethyl)piperidine-1-carboxylate XIAMEN SUMMIT BIOTECHNOLOGY CO 2010-04-28 CN disclosed
CN-101698658-A Method for preparing wormer sec-Butyl 2-(2-hydroxyethyl)piperidine-1-carboxylate XIAMEN SUMMIT BIOTECHNOLOGY CO 2010-04-28 CN disclosed
US-20100062083-A1 DERMAL FILM-FORMING LIQUID FORMULATIONS FOR DRUG RELEASE TO SKIN POLICHEM S.A. (IT) 2010-03-11 US disclosed
WO-2010022076-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-02-25 WO disclosed
CN-101641082-A Pellicle-forming liquid preparation for delivering a drug to the skin POLICHEM SA LU 2010-02-03 CN disclosed
EP-2117500-A1 DERMAL FILM-FORMING LIQUID FORMULATIONS FOR DRUG RELEASE TO SKIN Polichem SA (LU) 2009-11-18 EP disclosed
EP-2081911-A2 CYCLOPROPANECARBOXYLATES AND USE THEREOF AS PESTICIDES Sumitomo Chemical Company, Limited (JP) 2009-07-29 EP disclosed
EP-1778231-A4 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2009-06-03 EP disclosed
WO-2008098634-A1 DERMAL FILM-FORMING LIQUID FORMULATIONS FOR DRUG RELEASE TO SKIN POLICHEM S.A. (LU) 2008-08-21 WO disclosed
EP-1958613-A1 Dermal film-forming liquid formulations for drug release to skin POLICHEM S.A. (LU) 2008-08-20 EP disclosed
WO-2008032585-A2 CYCLOPROPANECARBOXYLATES AND USE THEREOF AS PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-03-20 WO disclosed
EP-1778231-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-05-02 EP disclosed
WO-2006020415-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-02-23 WO disclosed
CN-1228315-C Cyclopropane carboxylic acid ester and pest control agent containing the same SUMITOMO CHEMICAL CO (JP) 2005-11-23 CN disclosed
CN-1602297-A Cyclopropanecarboxylic acid esters and pest controllers containing the same SUMITOMO CHEMICAL CO (JP) 2005-03-30 CN disclosed
EP-0920319-A4 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO INC (US) 2002-05-02 EP disclosed
CN-1323307-A 1H-imidazopyridine derivatives HOKURIKU SEIYAKU (JP) 2001-11-21 CN disclosed
EP-0920319-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE Merck & Co., Inc. (US) 1999-06-09 EP disclosed
WO-1997044041-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO., INC. (US) 1997-11-27 WO disclosed
WO-1997044041-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO., INC. (US) 1997-11-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240025868-A1 PHENOTHIAZINE COMPOUNDS FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND OTHER AGE-RELATED AND NEUROLOGICAL DISEASES ACE2, BACE2, PSEN2 AKR1C3 4568/4885POLB 642/4885L3MBTL1 2587/4885
US-20180271771-A1 POLYURETHANEUREA SOLUTIONS FOR COMPOSITIONS WITH ACTIVE INGREDIENTS OR FRAGRANCES PUF60, UFM1, UMPS AKR1C3 628/4885POLB 772/4885L3MBTL1 3885/4885
US-20020165259-A1 Carbon substituted aminothiazole inhibitors of cyclin dependent kinases CCNK, CDK2, CCNL2 AKR1C3 811/4885POLB 1076/4885L3MBTL1 1831/4885
US-20200323212-A1 PEST CONTROL COMPOSITION AND USE OF SAME H1-2, H1-0, EGLN1 AKR1C3 2973/4885POLB 3774/4885L3MBTL1 71/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.