SCHEMBL14766277

SCHEMBL14766277

C=CCCOc1ccc(C2CCC(CCc3ccc(-c4ccc(OCCCC)cc4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 5/20 0.34
S1PR1 P21453 2/20 0.33
S1PR3 Q99500 2/20 0.33
FFAR1 O14842 2/20 0.32
CNR2 P34972 1/20 0.32
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31
CRBN Q96SW2 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
CYP2C9 P11712 1/20 0.30
MOGAT2 Q3SYC2 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
SCHEMBL14765782 0.97 FFAR4 (0.34) FFAR4S1PR1S1PR3FFAR1CNR2
SCHEMBL14765786 0.95 FFAR4 (0.36) FFAR4FFAR1
SCHEMBL14766380 0.94 FFAR4 (0.34) FFAR4S1PR1S1PR3FFAR1CNR2
SCHEMBL14765962 0.93 FFAR4 (0.37) FFAR4S1PR1S1PR3FFAR1CNR2
SCHEMBL12735233 0.92 CYP2C9 (0.35) FFAR4CYP2C9MOGAT2
SCHEMBL14766069 0.91 FFAR4 (0.36) FFAR4S1PR1S1PR3FFAR1CNR2
SCHEMBL14766397 0.91 FFAR4 (0.34) FFAR4S1PR1S1PR3FFAR1CNR2
SCHEMBL14765997 0.90 FFAR4 (0.41) FFAR4S1PR1S1PR3FFAR1CNR2
SCHEMBL12735238 0.90 CYP2C9 (0.34) FFAR4FFAR1CYP2C9MOGAT2
SCHEMBL14766325 0.89 CNR2 (0.32) FFAR4CNR2CHRM2CHRM4CHRM5

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