SCHEMBL14766827

SCHEMBL14766827

C=CCCOc1ccc(CCC2CCC(c3ccc(-c4ccc(OCC)cc4)c(F)c3F)CC2)cc1F

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
PPARD Q03181 4/20 0.32
FFAR1 O14842 3/20 0.32
FFAR4 Q5NUL3 2/20 0.32
PPARA Q07869 2/20 0.31
PPARG P37231 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
SCHEMBL14767026 0.94 CNR2 (0.35) GABRA1GABRB2PPARDFFAR1FFAR4
SCHEMBL14766710 0.93 CNR2 (0.35) GABRA1GABRB2PPARDFFAR1FFAR4
SCHEMBL14766807 0.92 ALDH1A1 (0.35) PPARDFFAR1FFAR4PPARAPPARG
SCHEMBL12739876 0.91 ALOX5AP (0.32) GABRA1GABRB2FFAR4
SCHEMBL14766847 0.91 FFAR4 (0.38) PPARDFFAR1FFAR4PPARAPPARG
SCHEMBL14766829 0.88 FFAR1 (0.36) GABRA1GABRB2PPARDFFAR1FFAR4
SCHEMBL12739880 0.88 ALOX5AP (0.32) GABRA1GABRB2FFAR4
SCHEMBL14766681 0.87 FFAR1 (0.40) PPARDFFAR1FFAR4PPARAPPARG
SCHEMBL14767203 0.87 FFAR4 (0.31) GABRA1GABRB2FFAR4
SCHEMBL14765884 0.87 FFAR4 (0.31) GABRA1GABRB2FFAR4

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