SCHEMBL14766829

SCHEMBL14766829

C=CCCOc1ccc(COC2CCC(c3ccc(-c4ccc(OCC)cc4)c(F)c3F)CC2)cc1F

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 8/20 0.36
PPARD Q03181 7/20 0.36
PPARA Q07869 2/20 0.35
PPARG P37231 1/20 0.35
NAAA Q02083 3/20 0.35
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
FFAR4 Q5NUL3 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
DRD4 P21917 2/20 0.31
SIGMAR1 Q99720 2/20 0.31
GYS1 P13807 1/20 0.31
TMEM97 Q5BJF2 1/20 0.31
HTR6 P50406 1/20 0.31

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
SCHEMBL14766954 0.95 GABRA1 (0.35) FFAR1PPARDPPARAPPARGNAAA
SCHEMBL14766882 0.95 PPARD (0.36) FFAR1PPARDPPARAPPARGNAAA
SCHEMBL14766852 0.92 GABRA1 (0.36) FFAR1PPARDPPARAPPARGNAAA
SCHEMBL14766837 0.92 GABRA1 (0.35) FFAR1PPARDPPARAPPARGNAAA
SCHEMBL14766867 0.91 GYS1 (0.38) FFAR1PPARDPPARAPPARGNAAA
SCHEMBL12740343 0.91 SIGMAR1 (0.39) NAAAGABRA1GABRB2FFAR4ALOX5AP
SCHEMBL14766979 0.90 FFAR1 (0.41) FFAR1PPARDPPARAPPARGNAAA
SCHEMBL14766718 0.90 PPARD (0.36) FFAR1PPARDPPARANAAAGABRA1
SCHEMBL14766790 0.89 GABRA1 (0.35) FFAR1PPARDPPARAPPARGNAAA
SCHEMBL14767246 0.89 DRD4 (0.36) FFAR1PPARDPPARAPPARGNAAA

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