SCHEMBL11272083

SCHEMBL11272083

CCCCCCCC1CCC(c2ccc(-c3ccc(C(F)(F)C(F)(F)F)cc3)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
SPHK1 Q9NYA1 5/20 0.41
GAA P10253 1/20 0.40
CYP2C9 P11712 1/20 0.40
MEN1 O00255 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
P2RY14 Q15391 1/20 0.38
CNR2 P34972 7/20 0.38
SPHK2 Q9NRA0 1/20 0.36

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
SCHEMBL11278285 1.00 MAPT (0.41) MAPTALDH1A1LMNASPHK1GAA
SCHEMBL11286749 1.00 MAPT (0.41) MAPTALDH1A1LMNASPHK1GAA
SCHEMBL11286048 1.00 MAPT (0.41) MAPTALDH1A1LMNASPHK1GAA
SCHEMBL11284312 1.00 MAPT (0.41) MAPTALDH1A1LMNASPHK1GAA
SCHEMBL11281791 0.99 MAPT (0.42) MAPTALDH1A1LMNASPHK1GAA
SCHEMBL11276734 0.95 ALDH1A1 (0.43) MAPTALDH1A1LMNASPHK1GAA
SCHEMBL11278507 0.92 MAPT (0.40) MAPTALDH1A1LMNASPHK1GAA
SCHEMBL11281602 0.92 MAPT (0.40) MAPTALDH1A1LMNASPHK1GAA
SCHEMBL11280300 0.92 MAPT (0.40) MAPTALDH1A1LMNASPHK1GAA
SCHEMBL11273913 0.92 MAPT (0.40) MAPTALDH1A1LMNASPHK1GAA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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