SCHEMBL11285243

SCHEMBL11285243

CCCCCCOc1ccc(-c2ccc(C3CCC(C)CC3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.52
RARB P10826 3/20 0.50
NR5A1 Q13285 1/20 0.47
HRH3 Q9Y5N1 6/20 0.47
LMNA P02545 1/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
S1PR3 Q99500 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.45
LTA4H P09960 1/20 0.44
HTR1B P28222 1/20 0.44
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
HTR2B P41595 1/20 0.44

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
SCHEMBL11283562 1.00 RAB9A (0.52) RAB9ARARBNR5A1HRH3LMNA
SCHEMBL11274828 1.00 RAB9A (0.52) RAB9ARARBNR5A1HRH3LMNA
SCHEMBL11287135 1.00 RAB9A (0.52) RAB9ARARBNR5A1HRH3LMNA
SCHEMBL11279143 1.00 RAB9A (0.52) RAB9ARARBNR5A1HRH3LMNA
SCHEMBL11277730 1.00 RAB9A (0.52) RAB9ARARBNR5A1HRH3LMNA
SCHEMBL11302126 1.00 RAB9A (0.52) RAB9ARARBNR5A1HRH3LMNA
SCHEMBL11276971 0.99 RAB9A (0.53) RAB9ARARBNR5A1HRH3LMNA
SCHEMBL11277004 0.96 RAB9A (0.56) RAB9ARARBHRH3CYP3A4CYP2D6
SCHEMBL13402152 0.93 RARB (0.51) RAB9ARARBNR5A1HRH3LMNA
SCHEMBL13402127 0.92 RAB9A (0.48) RAB9ARARBNR5A1HRH3LMNA

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-0022183-B1 DERIVATIVES OF CYCLOHEXYLBIPHENYL, PROCESS FOR THEIR PREPARATION, DIELECTRICS CONTAINING THEM, AND ELECTRON OPTICAL INDICATING ELEMENTS MERCK PATENT GmbH (DE) 1982-06-23 EP disclosed
US-4330426-A Cyclohexylbiphenyls, their preparation and use in dielectrics and electrooptical display elements MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1982-05-18 US disclosed
EP-0022183-A2 Derivatives of cyclohexylbiphenyl, process for their preparation, dielectrics containing them, and electron optical indicating elements MERCK PATENT GmbH (DE) 1981-01-14 EP disclosed