SCHEMBL11278210

SCHEMBL11278210

CCC1CCC(c2ccc(-c3ccc(C(F)(F)C(F)(F)C(F)(F)F)cc3)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 5/20 0.39
SOAT1 P35610 1/20 0.39
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 2/20 0.37
HTR2C P28335 2/20 0.36
ESR2 Q92731 3/20 0.36
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
ESR1 P03372 1/20 0.34
CYP3A4 P08684 1/20 0.34
IDO1 P14902 1/20 0.32
P2RY14 Q15391 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL11281207 0.96 DGAT1 (0.38) DGAT1SOAT1ALDH1A1LMNAMAPT
SCHEMBL11284940 0.94 DGAT1 (0.38) DGAT1SOAT1ALDH1A1LMNAMAPT
SCHEMBL11272782 0.91 DGAT1 (0.40) DGAT1SOAT1ALDH1A1LMNAMAPT
SCHEMBL11280593 0.90 ALDH1A1 (0.49) DGAT1SOAT1ALDH1A1LMNAMAPT
SCHEMBL11275063 0.89 DGAT1 (0.39) DGAT1SOAT1ALDH1A1LMNAMAPT
SCHEMBL11285293 0.88 MAPT (0.41) DGAT1SOAT1ALDH1A1LMNAMAPT
SCHEMBL9337341 0.87 ALDH1A1 (0.40) DGAT1SOAT1ALDH1A1LMNAMAPT
SCHEMBL9338983 0.87 ALDH1A1 (0.40) DGAT1SOAT1ALDH1A1LMNAMAPT
SCHEMBL9074750 0.87 ESR2 (0.40) DGAT1SOAT1ALDH1A1LMNAMAPT
SCHEMBL9074753 0.87 ESR2 (0.40) DGAT1SOAT1ALDH1A1LMNAMAPT

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