SCHEMBL14765874

SCHEMBL14765874

CCCCOc1ccc(C2CCC(CCc3ccc(-c4ccc(OCCC)cc4)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.34
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
FPR2 P25090 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
PPARD Q03181 2/20 0.31
PPARA Q07869 2/20 0.31
CNR2 P34972 1/20 0.30
PTGES O14684 1/20 0.30
ALOX5 P09917 1/20 0.30

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
SCHEMBL14766461 1.00 FFAR4 (0.34) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL14766259 0.98 FFAR4 (0.35) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL14766324 0.98 FFAR4 (0.35) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL14765881 0.95 FFAR4 (0.35) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL14766911 0.95 FFAR4 (0.35) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL14766394 0.92 CNR2 (0.32) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL14765769 0.92 CNR2 (0.32) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL12735089 0.92 FFAR4 (0.33) FFAR4
SCHEMBL12739816 0.92 FFAR4 (0.33) FFAR4
SCHEMBL14766325 0.91 CNR2 (0.32) FFAR4CHRM2CHRM4CHRM5CHRM1

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