SCHEMBL8023943

SCHEMBL8023943

CC(c1ccccc1)C1(O)CCC(=O)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.44
CYP2C9 P11712 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
OPRM1 P35372 4/20 0.42
OPRL1 P41146 4/20 0.42
OPRD1 P41143 3/20 0.42
OPRK1 P41145 3/20 0.42
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
GAA P10253 1/20 0.35
RECQL P46063 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35

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
SCHEMBL17086663 0.85 OPRM1 (0.50) OPRM1OPRL1OPRD1OPRK1ALDH1A1
SCHEMBL17086668 0.85 OPRM1 (0.50) OPRM1OPRL1OPRD1OPRK1ALDH1A1
SCHEMBL17086655 0.81 OPRM1 (0.47) OPRM1OPRL1OPRD1OPRK1CHRM2
SCHEMBL19494132 0.81 OPRM1 (0.47) OPRM1OPRL1OPRD1OPRK1CHRM2
SCHEMBL17086666 0.81 OPRM1 (0.47) OPRM1OPRL1OPRD1OPRK1CHRM2
SCHEMBL17086664 0.81 OPRM1 (0.47) OPRM1OPRL1OPRD1OPRK1CHRM2
SCHEMBL17086651 0.81 OPRM1 (0.47) OPRM1OPRL1OPRD1OPRK1CHRM2
SCHEMBL8124662 0.79 OPRM1 (0.46) OPRM1OPRL1OPRD1OPRK1CHRM2
SCHEMBL9717862 0.79 OPRM1 (0.46) OPRM1OPRL1OPRD1OPRK1CHRM2
SCHEMBL7290614 0.76 USP2 (0.45) CYP2C9MEN1KMT2AOPRM1OPRL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0780369-B1 1-Phenyl-2-dimethylaminomethyl-cyclohexan-1-ol derivatives as pharmaceutical agents GRUENENTHAL GMBH (DE) 2000-01-19 EP disclosed
US-5801201-A 1-phenyl-2-dimenthylaminomethyl-cyclohexan-1-ol compounds as pharmaceutical active ingredients GRUENENTHAL GMBH (DE) 1998-09-01 US disclosed
EP-0780369-A1 1-Phenyl-2-dimethylaminomethyl-cyclohexan-1-ol derivatives as pharmaceutical agents Grünenthal GmbH (DE) 1997-06-25 EP disclosed