SCHEMBL11289706

SCHEMBL11289706

CCCCCCCCC1CCC(c2ccc(-c3ccc(CC(C)CCC)cc3)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 13/20 0.44
SPHK2 Q9NRA0 7/20 0.39
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
BDKRB2 P30411 2/20 0.38

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
SCHEMBL11279466 1.00 SPHK1 (0.44) SPHK1SPHK2GAAMAPTCYP2C9
SCHEMBL11275591 1.00 SPHK1 (0.44) SPHK1SPHK2GAAMAPTCYP2C9
SCHEMBL11279323 1.00 SPHK1 (0.44) SPHK1SPHK2GAAMAPTCYP2C9
SCHEMBL11289161 1.00 SPHK1 (0.44) SPHK1SPHK2GAAMAPTCYP2C9
SCHEMBL11273974 1.00 SPHK1 (0.44) SPHK1SPHK2GAAMAPTCYP2C9
SCHEMBL11274370 1.00 SPHK1 (0.44) SPHK1SPHK2GAAMAPTCYP2C9
SCHEMBL11275180 0.99 SPHK1 (0.42) SPHK1SPHK2MAPTCYP2C9BDKRB2
SCHEMBL11282757 0.95 SPHK1 (0.40) SPHK1SPHK2MAPTCYP2C9BDKRB2
SCHEMBL11282469 0.91 SPHK1 (0.45) SPHK1SPHK2GAAMAPTCYP2C9
SCHEMBL11283612 0.91 SPHK1 (0.45) SPHK1SPHK2GAAMAPTCYP2C9

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