SCHEMBL11285346

SCHEMBL11285346

CCCCCC1CCC(c2ccc(-c3ccc(C(F)(F)F)cc3)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.46
P2RY14 Q15391 3/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.43
CYP2C9 P11712 1/20 0.43
SPHK1 Q9NYA1 3/20 0.42
DGAT1 O75907 1/20 0.41
SOAT1 P35610 1/20 0.41
MEN1 O00255 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
LSS P48449 2/20 0.40
ESR2 Q92731 1/20 0.39

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
SCHEMBL10453440 1.00 HTR2C (0.46) HTR2CP2RY14MAPTALDH1A1LMNA
SCHEMBL11279377 0.99 P2RY14 (0.46) HTR2CP2RY14MAPTALDH1A1LMNA
SCHEMBL11280596 0.99 P2RY14 (0.46) HTR2CP2RY14MAPTALDH1A1LMNA
SCHEMBL11286293 0.99 P2RY14 (0.46) HTR2CP2RY14MAPTALDH1A1LMNA
SCHEMBL11287293 0.99 P2RY14 (0.46) HTR2CP2RY14MAPTALDH1A1LMNA
SCHEMBL11277537 0.99 P2RY14 (0.46) HTR2CP2RY14MAPTALDH1A1LMNA
SCHEMBL11286081 0.96 HTR2C (0.47) HTR2CP2RY14MAPTALDH1A1LMNA
SCHEMBL8997274 0.96 HTR2C (0.50) HTR2CMAPTALDH1A1LMNAGAA
SCHEMBL9627141 0.96 HTR2C (0.50) HTR2CMAPTALDH1A1LMNAGAA
SCHEMBL9347697 0.94 HTR2C (0.49) HTR2CMAPTALDH1A1LMNAGAA

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