SCHEMBL14766602

SCHEMBL14766602

C=CCCOc1ccc(COc2ccc(-c3ccc(C4CCC(OCC)CC4)c(F)c3F)cc2)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 6/20 0.36
ACACA Q13085 1/20 0.33
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
NAAA Q02083 3/20 0.31
FFAR1 O14842 2/20 0.31
NR1H4 Q96RI1 1/20 0.30
HTR6 P50406 1/20 0.30
GYS1 P13807 1/20 0.30
PDCD1 Q15116 1/20 0.30
CD274 Q9NZQ7 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30
KCNH2 Q12809 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
SCHEMBL14766524 0.95 FFAR4 (0.36) FFAR4ACACAALOX5APFEN1FFAR1
SCHEMBL14766601 0.94 FFAR4 (0.36) FFAR4ACACAALOX5APFEN1NAAA
SCHEMBL14766870 0.94 FFAR4 (0.35) FFAR4ACACAALOX5APFEN1NAAA
SCHEMBL14767254 0.93 FFAR4 (0.34) FFAR4ALOX5APFEN1NAAAFFAR1
SCHEMBL14767169 0.92 FFAR4 (0.36) FFAR4ACACAALOX5APFEN1NAAA
SCHEMBL14766773 0.91 FFAR4 (0.37) FFAR4ACACAALOX5APFEN1NAAA
SCHEMBL14766941 0.91 NAAA (0.33) ACACAALOX5APFEN1NAAAHTR6
SCHEMBL14766570 0.91 FFAR4 (0.35) FFAR4GABRA1GABRB2
SCHEMBL12740371 0.90 CYP2C9 (0.34) FFAR4ALOX5APFEN1NAAAFFAR1
SCHEMBL14766732 0.90 FFAR4 (0.34) FFAR4NAAAFFAR1

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