SCHEMBL14767273

SCHEMBL14767273

CCOc1ccc(COc2ccc(-c3ccc(C4CCC(OCC)CC4)c(F)c3F)cc2)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 6/20 0.40
NAAA Q02083 3/20 0.37
FFAR1 O14842 2/20 0.35
PPARD Q03181 1/20 0.35
ACACA Q13085 1/20 0.35
GYS1 P13807 2/20 0.34
CACNA1C Q13936 1/20 0.34
KCNH2 Q12809 1/20 0.33
HTR6 P50406 1/20 0.33
MAOB P27338 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
ESR1 P03372 1/20 0.33

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
SCHEMBL14767021 0.95 NAAA (0.40) FFAR4NAAAFFAR1PPARDALOX5AP
SCHEMBL14766222 0.94 FFAR4 (0.40) FFAR4NAAAFFAR1PPARDACACA
SCHEMBL14767144 0.92 FFAR4 (0.39) FFAR4NAAAFFAR1PPARDACACA
SCHEMBL12823508 0.92 FFAR4 (0.40) FFAR4NAAAFFAR1PPARDACACA
SCHEMBL12740453 0.91 FFAR4 (0.40) FFAR4NAAAFFAR1PPARDACACA
SCHEMBL14766773 0.91 FFAR4 (0.37) FFAR4NAAAFFAR1ACACAGYS1
SCHEMBL14766606 0.90 FFAR4 (0.40) FFAR4NAAAFFAR1PPARDESR1
SCHEMBL12740363 0.90 NAAA (0.39) FFAR4NAAAFFAR1HTR6ALOX5AP
SCHEMBL12740442 0.90 FFAR4 (0.40) FFAR4NAAAFFAR1PPARDACACA
SCHEMBL12718970 0.90 NAAA (0.41) FFAR4NAAAALOX5APFEN1

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