SCHEMBL1299548

SCHEMBL1299548

O=CC1(c2ccccc2)CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C1 Q04828 1/20 0.45
HDAC4 P56524 1/20 0.43
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
CYP2B6 P20813 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
PRCP P42785 1/20 0.42
SLC6A3 Q01959 1/20 0.42
GRIN1 Q05586 1/20 0.42
KCNH2 Q12809 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
DPP4 P27487 1/20 0.41
MEN1 O00255 1/20 0.41

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
Hydrochloric Acid SCHEMBL28583230 0.98 OPRM1 (0.44) AKR1C1HDAC4GRIN2DGRIN3BCYP2B6
SCHEMBL1152247 0.98 AKR1C1 (0.47) AKR1C1HDAC4GRIN2DGRIN3BCYP2B6
Hydrochloric Acid SCHEMBL28579273 0.96 AKR1C1 (0.45) AKR1C1HDAC4GRIN2DGRIN3BCYP2B6
SCHEMBL1553 0.93 AKR1C1 (0.42) AKR1C1HDAC4OPRM1DPP4MEN1
Hydrochloric Acid SCHEMBL28589025 0.91 AKR1C1 (0.41) AKR1C1HDAC4OPRM1OPRD1DPP4
SCHEMBL568885 0.89 MEN1 (0.41) AKR1C1HDAC4OPRM1DPP4MEN1
SCHEMBL29002067 0.88 SLC6A2 (0.50) AKR1C1SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL28581691 0.86 MEN1 (0.40) AKR1C1OPRM1OPRD1MEN1KMT2A
SCHEMBL3885322 0.81 MEN1 (0.36) AKR1C1HDAC4OPRM1DPP4MEN1
SCHEMBL5197233 0.80 AKR1C1 (0.40) AKR1C1HDAC4GRIN2DGRIN3BCYP2B6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112759587-B 3- (dimethylamino methyl) piperidine-4-alcohol derivative and preparation method and pharmaceutical application thereof 复旦大学 2022-12-30 CN claimed
CN-109369406-B Photocatalytic synthesis method and application of 1-hydroxycyclohexyl phenyl ketone compound 甘肃金盾化工有限责任公司 2021-12-14 CN claimed
CN-112759587-A 3- (dimethylamino methyl) piperidine-4-alcohol derivative and preparation method and pharmaceutical application thereof 复旦大学 2021-05-07 CN claimed
CN-109814336-A Alkali soluble negative photosensitive polyimide resin combination 深圳市道尔顿电子材料有限公司 2019-05-28 CN claimed
CN-109369406-A A kind of photocatalytic synthesis method of 1- hydroxycyclohexyl phenyl ketone class compound and its application 甘肃金盾化工有限责任公司 2019-02-22 CN claimed
CN-104293213-B A kind of high tenacity low toxicity ultraviolet cured adhesive and preparation method thereof CHENGDU NASHUO TECHNOLOGY CO., LTD. (CN) 2016-04-20 CN claimed
CN-103282396-B Aromatic hydrocarbon resin, composition for forming lithographic underlayer film, and method for forming multilayer resist pattern MITSUBISHI GAS CHEMICAL CO 2015-03-18 CN claimed
CN-104293213-A High-ductility low-toxicity ultraviolet light polymerization glue and preparation method thereof CHENGDU NASHUO TECHNOLOGY CO 2015-01-21 CN claimed
CN-102574963-B Aromatic hydrocarbon resin and underlayer film forming composition for lithography MITSUBISHI GAS CHEMICAL CO 2014-11-19 CN claimed
CN-103282396-A Aromatic hydrocarbon resin, composition for forming lithographic underlayer film, and method for forming multilayer resist pattern MITSUBISHI GAS CHEMICAL CO 2013-09-04 CN claimed
CN-102827139-A Liquid crystal monomer laterally-fluorinated cyclohexane-epoxyethane compound and synthesis method thereof SHANDONG SHENGHUA ELECTRONIC NEW MATERIALS CO LTD 2012-12-19 CN claimed
CN-102574963-A Aromatic hydrocarbon resin and underlayer film forming composition for lithography MITSUBISHI GAS CHEMICAL CO 2012-07-11 CN claimed
US-20100179343-A1 METHOD OF PRODUCING AN OPTICALLY ACTIVE CYANOHYDRIN DERIVATIVE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2010-07-15 US claimed
WO-2008121074-A1 METHOD OF PRODUCING AN OPTICALLY ACTIVE CYANOHYDRIN DERIVATIVE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2008-10-09 WO claimed
EP-1311554-B1 METHOD FOR PRODUCING ADHESIVE POLYACRYLATES USING MERCAPTO FUNCTIONAL PHOTOINITIATORS TESA AG (DE) 2004-11-03 EP claimed
US-20040049972-A1 Method for producing adhesive polyacrylates using mercapto functional photoinitiators TESA AG (DE) 2004-03-18 US claimed
EP-1000047-B1 1-(N-PHENYLAMINOALKYL)-PIPERAZINE DERIVATIVES SUBSTITUTED AT POSITION 2 OF THE PHENYL RING RECORDATI CHEM PHARM (CH) 2003-12-17 EP claimed
JP-9143108-A None JP disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP disclosed
US-4210602-A REDUCTIVE ALKYLATION OF PARA-NITROSO-DIPHENYLHYDROXYLAMINE AKZONA INCORPORATED (US) 1980-07-01 US 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 (1 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-20100179343-A1 METHOD OF PRODUCING AN OPTICALLY ACTIVE CYANOHYDRIN DERIVATIVE TDO2, AOX1, DAO AKR1C1 766/4885HDAC4 1548/4885GRIN2D 2878/4885

“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.