SCHEMBL14766570

SCHEMBL14766570

C=CCCOc1ccc(CCc2ccc(-c3ccc(C4CCC(OCC)CC4)c(F)c3F)cc2)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.35
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
S1PR1 P21453 2/20 0.32
S1PR3 Q99500 2/20 0.32

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
SCHEMBL14766879 0.94 FFAR4 (0.36) FFAR4GABRA1GABRB2S1PR1S1PR3
SCHEMBL14766285 0.94 FFAR4 (0.35) FFAR4GABRA1GABRB2S1PR1S1PR3
SCHEMBL14766875 0.92 FFAR4 (0.36) FFAR4GABRA1GABRB2S1PR1S1PR3
SCHEMBL14766587 0.91 FFAR4 (0.36) FFAR4GABRA1GABRB2
SCHEMBL14766602 0.91 FFAR4 (0.36) FFAR4GABRA1GABRB2
SCHEMBL12740069 0.91 FFAR4 (0.37) FFAR4S1PR1S1PR3
SCHEMBL14766903 0.89 FFAR4 (0.39) FFAR4S1PR1S1PR3
SCHEMBL14766821 0.89 GABRA1 (0.36) FFAR4GABRA1GABRB2
SCHEMBL14765942 0.89 GABRA1 (0.36) FFAR4GABRA1GABRB2
SCHEMBL14765960 0.89 S1PR1 (0.38) FFAR4GABRA1GABRB2S1PR1S1PR3

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