SCHEMBL11276348

SCHEMBL11276348

CCCCCCCCCCC1CCC(c2ccc(-c3ccc(CCC)cc3)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 13/20 0.57
SPHK2 Q9NRA0 7/20 0.50
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
CYP2C9 P11712 1/20 0.43
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MEN1 O00255 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL11279119 1.00 SPHK1 (0.57) SPHK1SPHK2MAPTGAACYP2C9
SCHEMBL11276529 1.00 SPHK1 (0.57) SPHK1SPHK2MAPTGAACYP2C9
SCHEMBL11283046 1.00 SPHK1 (0.57) SPHK1SPHK2MAPTGAACYP2C9
SCHEMBL11278870 1.00 SPHK1 (0.57) SPHK1SPHK2MAPTGAACYP2C9
SCHEMBL11271469 1.00 SPHK1 (0.57) SPHK1SPHK2MAPTGAACYP2C9
SCHEMBL11283112 1.00 SPHK1 (0.57) SPHK1SPHK2MAPTGAACYP2C9
SCHEMBL11277627 0.99 SPHK1 (0.55) SPHK1SPHK2MAPTGAACYP2C9
SCHEMBL8522462 0.97 SPHK1 (0.54) SPHK1SPHK2MAPTGAACYP2C9
SCHEMBL8083689 0.97 SPHK1 (0.54) SPHK1SPHK2MAPTGAACYP2C9
SCHEMBL21084420 0.96 SPHK1 (0.61) SPHK1SPHK2MAPTGAACYP2C9

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