SCHEMBL14767254

SCHEMBL14767254

C=CCCOc1ccc(COC2CCC(c3ccc(-c4ccc(OCCCC)cc4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 4/20 0.34
NAAA Q02083 4/20 0.33
FFAR1 O14842 2/20 0.33
S1PR1 P21453 2/20 0.32
S1PR3 Q99500 2/20 0.32
HTR2A P28223 2/20 0.31
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31
CRBN Q96SW2 1/20 0.31
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
MCL1 Q07820 1/20 0.30
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRB2 P47870 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
SCHEMBL14766732 0.97 FFAR4 (0.34) FFAR4NAAAFFAR1S1PR1S1PR3
SCHEMBL14766601 0.96 FFAR4 (0.36) FFAR4NAAAFFAR1S1PR1S1PR3
SCHEMBL14766870 0.96 FFAR4 (0.35) FFAR4NAAAFFAR1ALOX5APFEN1
SCHEMBL14767169 0.93 FFAR4 (0.36) FFAR4NAAAFFAR1S1PR1S1PR3
SCHEMBL14766602 0.93 FFAR4 (0.36) FFAR4NAAAFFAR1ALOX5APFEN1
SCHEMBL14766184 0.93 FFAR4 (0.35) FFAR4FFAR1S1PR1S1PR3RARA
SCHEMBL14767129 0.93 FFAR4 (0.38) FFAR4NAAAFFAR1S1PR1S1PR3
SCHEMBL12740371 0.92 CYP2C9 (0.34) FFAR4NAAAFFAR1ALOX5APFEN1
SCHEMBL14766668 0.92 CRBN (0.33) NAAAFFAR1HTR2ACRBN
SCHEMBL14766679 0.91 FFAR4 (0.37) FFAR4NAAAFFAR1S1PR1S1PR3

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