SCHEMBL11278902

SCHEMBL11278902

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

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.37
MAPT P10636 2/20 0.37
GAA P10253 1/20 0.37
SPHK1 Q9NYA1 3/20 0.37
CYP2C9 P11712 2/20 0.36
S1PR3 Q99500 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
RARB P10826 3/20 0.34
FFAR1 O14842 1/20 0.34
GPR88 Q9GZN0 1/20 0.34

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
SCHEMBL11285684 1.00 RAB9A (0.37) RAB9AMAPTGAASPHK1CYP2C9
SCHEMBL11285915 1.00 RAB9A (0.37) RAB9AMAPTGAASPHK1CYP2C9
SCHEMBL11271548 1.00 RAB9A (0.37) RAB9AMAPTGAASPHK1CYP2C9
SCHEMBL11288482 1.00 RAB9A (0.37) RAB9AMAPTGAASPHK1CYP2C9
SCHEMBL11283596 1.00 RAB9A (0.37) RAB9AMAPTGAASPHK1CYP2C9
SCHEMBL11283114 1.00 RAB9A (0.37) RAB9AMAPTGAASPHK1CYP2C9
SCHEMBL11284189 0.99 RAB9A (0.38) RAB9AMAPTGAASPHK1CYP2C9
SCHEMBL11275191 0.95 RAB9A (0.39) RAB9AMAPTGAASPHK1CYP2C9
SCHEMBL11277030 0.92 GPR88 (0.38) RAB9AMAPTGAASPHK1CYP2C9
SCHEMBL11275973 0.92 GPR88 (0.38) RAB9AMAPTGAASPHK1CYP2C9

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