SCHEMBL8612396

SCHEMBL8612396

CC1=CCC[C@]1(C)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.39
OPRL1 P41146 2/20 0.39
OPRK1 P41145 1/20 0.39
CCR2 P41597 1/20 0.38
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
PAX8 Q06710 1/20 0.36
MCL1 Q07820 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SIGMAR1 Q99720 1/20 0.33
PNMT P11086 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
DRD4 P21917 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33

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
SCHEMBL27277978 1.00 OPRM1 (0.39) OPRM1OPRL1OPRK1CCR2ALDH1A1
SCHEMBL11309793 0.76 KDM1A (0.45) OPRM1OPRL1OPRK1ALDH1A1SIGMAR1
SCHEMBL28224382 0.73 MEN1 (0.40) OPRM1OPRL1OPRK1CCR2ALDH1A1
SCHEMBL6404032 0.70 OPRM1 (0.41) OPRM1OPRL1OPRK1CCR2ALDH1A1
SCHEMBL11470470 0.69 OPRM1 (0.41) OPRM1OPRL1OPRK1ALDH1A1LMNA
Diethylamine SCHEMBL11101906 0.68 KDM1A (0.36) OPRM1OPRL1OPRK1CCR2MMP1
SCHEMBL11459652 0.65 OPRL1 (0.42) OPRM1OPRL1OPRK1CCR2SIGMAR1
SCHEMBL498014 0.64 OPRM1 (0.50) OPRM1OPRL1OPRK1ALDH1A1LMNA
SCHEMBL30312220 0.64 OPRM1 (0.50) OPRM1OPRL1OPRK1ALDH1A1LMNA
SCHEMBL30550560 0.64 CCR2 (0.33) OPRM1OPRL1OPRK1CCR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5827855-A ANTICHOLESTEROL AGENTS TREATING CARDIOVASCULAR DISORDERS; ENZYME INHIBITORS SANKYO COMPANY, LIMITED (JP) 1998-10-27 US disclosed
CN-1039642-C Derivative of hexahydronaphthalene ester, their preparation and their therapeutic uses SANKYO CO (JP) 1998-09-02 CN disclosed
EP-0605230-B1 Hexahydronaphthalene ester derivatives, their preparation and their therapeutic uses SANKYO CO (JP) 1997-08-27 EP disclosed
US-5451688-A Inhibit biosynthesis of cholesterol SANKYO COMPANY, LIMITED (JP) 1995-09-19 US disclosed
CN-1094707-A Hexahydro-naphthalene ester derivative, their preparation and their application aspect treatment SANKYO CO (JP) 1994-11-09 CN disclosed
EP-0605230-A1 Hexanhydronaphthalene ester derivatives, their preparation and their therapeutic uses SANKYO COMPANY LIMITED (JP) 1994-07-06 EP disclosed