SCHEMBL8558032

SCHEMBL8558032

CCCCCOC1CCC(c2ccccc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.45
SPHK1 Q9NYA1 2/20 0.41
HCRTR2 O43614 3/20 0.41
KDM4E B2RXH2 1/20 0.40
LTA4H P09960 1/20 0.40
PPARG P37231 3/20 0.40
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL11619194 0.95 DRD2 (0.46) DRD2HCRTR2KDM4ELTA4H
SCHEMBL11263811 0.90 HCRTR2 (0.41) DRD2SPHK1HCRTR2PPARG
SCHEMBL11254714 0.90 HCRTR2 (0.41) DRD2SPHK1HCRTR2PPARG
SCHEMBL11263813 0.90 HCRTR2 (0.41) DRD2SPHK1HCRTR2PPARG
SCHEMBL11254705 0.90 HCRTR2 (0.41) DRD2SPHK1HCRTR2PPARG
SCHEMBL26941799 0.88 DRD2 (0.49) DRD2HCRTR2KDM4E
SCHEMBL11260150 0.87 HCRTR2 (0.42) DRD2HCRTR2
SCHEMBL11260153 0.87 HCRTR2 (0.42) DRD2HCRTR2
SCHEMBL14618505 0.86 SPHK1 (0.43) SPHK1
SCHEMBL10938939 0.86 SPHK1 (0.40) SPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0757669-B1 O-ACYL-4-PHENYL-CYCLOHEXANOLS, THEIR SALTS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE, AS WELL AS A METHOD OF PREPARING THEM BOEHRINGER INGELHEIM PHARMA (DE) 1998-11-18 EP claimed
US-5962507-A BLOCKING CHOLESTEROL BIOSYNTHESIS DR. KARL THOMAE GMBH (DE) 1999-10-05 US disclosed
US-5962507-A BLOCKING CHOLESTEROL BIOSYNTHESIS DR. KARL THOMAE GMBH (DE) 1999-10-05 US disclosed
EP-0757669-B1 O-ACYL-4-PHENYL-CYCLOHEXANOLS, THEIR SALTS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE, AS WELL AS A METHOD OF PREPARING THEM BOEHRINGER INGELHEIM PHARMA (DE) 1998-11-18 EP disclosed
US-5726205-A ANTICHOLESTEROL AGENTS KARL THOMAE GMBH (DE) 1998-03-10 US disclosed
CN-1147809-A 0-acyl-4-phenyl-cyclohexanols, their salts, medicaments containing such compounds and their use, as well as a method of preparing them THOMAE GMBH DR K (DE) 1997-04-16 CN disclosed
EP-0757669-A1 O-ACYL-4-PHENYL-CYCLOHEXANOLS, THEIR SALTS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE, AS WELL AS A METHOD OF PREPARING THEM Dr. Karl Thomae GmbH (DE) 1997-02-12 EP disclosed
WO-1995029148-A1 O-ACYL-4-PHENYL-CYCLOHEXANOLS, THEIR SALTS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE, AS WELL AS A METHOD OF PREPARING THEM DR. KARL THOMAE GMBH (DE) 1995-11-02 WO disclosed