SCHEMBL11287706

SCHEMBL11287706

CCCCCC(C)COc1ccc(-c2ccc(C3CCC(CCCC)CC3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.37
MAPT P10636 2/20 0.37
CYP2C9 P11712 2/20 0.36
GPR88 Q9GZN0 4/20 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
SPHK1 Q9NYA1 2/20 0.34
SIGMAR1 Q99720 2/20 0.34
S1PR3 Q99500 1/20 0.34
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL11284184 0.98 GPR88 (0.38) RAB9AMAPTCYP2C9GPR88HRH3
SCHEMBL11286172 0.97 GPR88 (0.38) RAB9AMAPTCYP2C9GPR88HRH3
SCHEMBL11287853 0.97 GPR88 (0.38) RAB9AMAPTCYP2C9GPR88HRH3
SCHEMBL11270589 0.97 GPR88 (0.38) RAB9AMAPTCYP2C9GPR88HRH3
SCHEMBL11277030 0.97 GPR88 (0.38) RAB9AMAPTCYP2C9GPR88HRH3
SCHEMBL11275973 0.97 GPR88 (0.38) RAB9AMAPTCYP2C9GPR88HRH3
SCHEMBL11282603 0.95 CYP2C9 (0.41) RAB9AMAPTCYP2C9GPR88HRH3
SCHEMBL11281220 0.92 RAB9A (0.38) RAB9ACYP2C9GPR88HRH3LMNA
SCHEMBL11275191 0.91 RAB9A (0.39) RAB9AMAPTCYP2C9HRH3ALDH1A1
SCHEMBL11284189 0.89 RAB9A (0.38) RAB9AMAPTCYP2C9GPR88HRH3

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