SCHEMBL11273553

SCHEMBL11273553

CCCCCc1ccc(-c2ccc(C3CCC(CC)CC3)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 13/20 0.64
SPHK2 Q9NRA0 7/20 0.56
HRH3 Q9Y5N1 1/20 0.46
RARB P10826 3/20 0.45
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45

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
SCHEMBL10359166 0.98 SPHK1 (0.67) SPHK1SPHK2RARBTSHRHSD17B10
SCHEMBL11275238 0.98 SPHK1 (0.67) SPHK1SPHK2RARBTSHRHSD17B10
SCHEMBL11280901 0.98 SPHK1 (0.67) SPHK1SPHK2RARBTSHRHSD17B10
SCHEMBL11274592 0.98 SPHK1 (0.67) SPHK1SPHK2RARBTSHRHSD17B10
SCHEMBL11273814 0.98 SPHK1 (0.67) SPHK1SPHK2RARBTSHRHSD17B10
SCHEMBL11289114 0.98 SPHK1 (0.67) SPHK1SPHK2RARBTSHRHSD17B10
SCHEMBL11282909 0.98 SPHK1 (0.67) SPHK1SPHK2RARBTSHRHSD17B10
SCHEMBL11286214 0.95 SPHK1 (0.57) SPHK1SPHK2RARB
SCHEMBL10658046 0.94 SPHK1 (0.72) SPHK1SPHK2HSD17B10
SCHEMBL10658045 0.94 SPHK1 (0.72) SPHK1SPHK2HSD17B10

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