SCHEMBL14765953

SCHEMBL14765953

CCCCOc1ccc(C2CCC(/C=C/c3ccc(-c4ccc(OCCC)cc4)c(F)c3F)CC2)cc1F

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.33
RAB9A P51151 1/20 0.32
FFAR4 Q5NUL3 2/20 0.32
RARA P10276 1/20 0.32
RARB P10826 1/20 0.32
ERN1 O75460 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
KDM1A O60341 2/20 0.31
CYP2C9 P11712 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
PPARG P37231 2/20 0.31
PPARA Q07869 1/20 0.31

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
SCHEMBL14765899 0.98 RAB9A (0.33) RAB9AFFAR4RARARARBCHRM2
SCHEMBL14765714 0.95 KDM1A (0.37) FPR2RAB9AFFAR4RARARARB
SCHEMBL14765732 0.93 CNR2 (0.31)
SCHEMBL14765697 0.93 CNR2 (0.31) FFAR4KDM1A
SCHEMBL12734290 0.92 KDM1A (0.31) KDM1APDE4APDE4BPDE4CPDE4D
SCHEMBL12734292 0.90 THRB (0.32) FPR2KDM1A
SCHEMBL14765696 0.89 KDM1A (0.39) FPR2FFAR4ERN1KDM1APPARG
SCHEMBL12734300 0.89 THRB (0.34) FPR2KDM1A
SCHEMBL12734296 0.89 THRB (0.34) FPR2KDM1A
SCHEMBL12734298 0.89 THRB (0.34) FPR2KDM1A

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed