SCHEMBL5236196

SCHEMBL5236196

COCCOC1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.50
ACHE P22303 1/20 0.34
LMNA P02545 1/20 0.34
EPHX2 P34913 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
EPHX1 P07099 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NAAA Q02083 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL2976961 1.00 NPC1 (0.50) NPC1ACHELMNAEPHX2SMN1; SMN2
SCHEMBL11228022 1.00 NPC1 (0.50) NPC1ACHELMNAEPHX2SMN1; SMN2
SCHEMBL15362702 1.00 NPC1 (0.50) NPC1ACHELMNAEPHX2SMN1; SMN2
SCHEMBL14359727 0.97 NPC1 (0.46) NPC1ACHELMNAEPHX2SMN1; SMN2
SCHEMBL28236249 0.93 NPC1 (0.45) NPC1ACHELMNAEPHX2SMN1; SMN2
SCHEMBL22414144 0.93 NPC1 (0.45) NPC1ACHELMNAEPHX2SMN1; SMN2
SCHEMBL18330523 0.92
SCHEMBL9958288 0.91 NPC1 (0.44) NPC1ACHELMNAEPHX2SMN1; SMN2
SCHEMBL11350663 0.91 NPC1 (0.42) NPC1EPHX2CA2
SCHEMBL3152054 0.89 NPC1 (0.42) NPC1LMNAEPHX2

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111171272-A Novel composite ion solvent-free waterborne polyurethane and preparation method thereof 山东天庆科技发展有限公司 2020-05-19 CN claimed
CN-114395103-B Aqueous polyurethane impregnating resin for microfiber synthetic leather and preparation method thereof 明新梅诺卡(江苏)新材料有限公司 2024-05-03 CN disclosed
US-20230312605-A1 PYRROLO[2,1-F][1,2,4]TRIAZINES AND PREPARATION AND USES THEREOF TENARX, INC. 2023-10-05 US disclosed
WO-2023064366-A1 PYRROLO[2,1-F][1,2,4]TRIAZINES DERIVATIVES AS INHIBITORS OF DYRK1A BIOSPLICE THERAPEUTICS, INC. (US) 2023-04-20 WO disclosed
US-8058565-B2 Wiring board, semiconductor device, and method for manufacturing wiring board NEC CORPORATION (JP) 2011-11-15 US disclosed
US-20070274060-A1 WIRING BOARD, SEMICONDUCTOR DEVICE, AND METHOD FOR MANUFACTURING WIRING BOARD NEC CORPORATION (JP) 2007-11-29 US disclosed
US-20070265289-A1 2-Aminopyrimidine Derivative ASTELLAS PHARMA INC. (JP) 2007-11-15 US disclosed
US-20070265289-A1 2-Aminopyrimidine Derivative ASTELLAS PHARMA INC. (JP) 2007-11-15 US disclosed
EP-1228070-B1 HETEROALKYLAMINO-SUBSTITUTED BICYCLIC NITROGEN HETEROCYCLES AS INHIBITORS OF P38 PROTEIN KINASE HOFFMANN LA ROCHE (CH) 2007-02-07 EP disclosed
US-20050232915-A1 Matrix metalloproteinase inhibitors in combination with hypothermia and/or radiotherapy for the treatment of cancer NAKAJIMA MOTOWO 2005-10-20 US disclosed
EP-0929517-B1 HYDROXAMIC ACID DERIVATIVES NOVARTIS AG (CH) 2002-06-12 EP disclosed
US-20020038045-A1 Hydroxamic acid derivatives NOVARTIS AG (CH) 2002-03-28 US disclosed
CN-1070524-C Non-aqueous ink for ball-point pen MITSUBISHI PENCIL CO (JP) 2001-09-05 CN disclosed
WO-2001029042-A1 HETEROALKYLAMINO-SUBSTITUTED BICYCLIC NITROGEN HETEROCYCLES AS INHIBITORS OF P38 PROTEIN KINASE F. HOFFMANN-LA ROCHE AG (CH) 2001-04-26 WO disclosed
EP-0929517-A1 HYDROXAMIC ACID DERIVATIVES Novartis AG (CH) 1999-07-21 EP disclosed
WO-1998014424-A1 HYDROXAMIC ACID DERIVATIVES NOVARTIS AG (CH) 1998-04-09 WO disclosed
US-5414144-A Detergent, solvent, film-forming agent ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1995-05-09 US disclosed
US-4317942-A Odoriferous 2-alkoxyethyl-cycloalkyl-ethers CHEMISCHE WERKE HUELS, AKTIENGESELLSCHAFT (DE) 1982-03-02 US disclosed
EP-0022462-B1 2-ALKOXYETHYL-CYCLOALKYL-ETHERS, COMPOSITIONS CONTAINING THESE, AND THEIR UTILIZATION FOR THE PREPARATION OF ODORANT COMPOSITIONS CHEMISCHE WERKE HÜLS AG (DE) 1981-11-25 EP disclosed
EP-0022462-A1 2-Alkoxyethyl-cycloalkyl-ethers, compositions containing these, and their utilization for the preparation of odorant compositions CHEMISCHE WERKE HÜLS AG (DE) 1981-01-21 EP 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-20230312605-A1 PYRROLO[2,1-F][1,2,4]TRIAZINES AND PREPARATION AND USES THEREOF DYRK1A, DYRK2, DYRK1B NPC1 4100/4885ACHE 3271/4885LMNA 3598/4885
US-20070265289-A1 2-Aminopyrimidine Derivative NFKBIA, IKBKG, NFKB2 NPC1 4389/4885ACHE 3533/4885LMNA 4358/4885
US-20050232915-A1 Matrix metalloproteinase inhibitors in combination with hypothermia and/or radiotherapy for the treatment of cancer MMP3, TIMP3, MMP25 NPC1 3494/4885ACHE 2442/4885LMNA 1706/4885
US-20020038045-A1 Hydroxamic acid derivatives TNF, HCAR2, HCAR1 NPC1 4466/4885ACHE 2048/4885LMNA 4203/4885

“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.