SCHEMBL14766959

SCHEMBL14766959

CCCCOc1ccc(OCc2ccc(-c3ccc(C4CCC(OCCC)CC4)c(F)c3F)cc2)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 14/20 0.38
PPARD Q03181 10/20 0.38
NAAA Q02083 1/20 0.36
S1PR1 P21453 2/20 0.35
S1PR3 Q99500 2/20 0.35
FFAR4 Q5NUL3 1/20 0.33
HTR1A P08908 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
F10 P00742 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
SCHEMBL14766617 0.97 FFAR1 (0.37) FFAR1PPARDNAAAS1PR1S1PR3
SCHEMBL14767037 0.96 FFAR1 (0.38) FFAR1PPARDNAAAFFAR4F10
SCHEMBL14766765 0.95 FFAR1 (0.39) FFAR1PPARDNAAAS1PR1S1PR3
SCHEMBL14765913 0.94 S1PR1 (0.39) FFAR1PPARDNAAAS1PR1S1PR3
SCHEMBL14767111 0.94 FFAR1 (0.38) FFAR1PPARDNAAAFFAR4F10
SCHEMBL14766964 0.93 FFAR1 (0.39) FFAR1PPARDNAAAFFAR4F10
SCHEMBL14766799 0.92 FFAR1 (0.34) FFAR1PPARDNAAAS1PR1S1PR3
SCHEMBL14766598 0.91 PPARD (0.37) FFAR1PPARDNAAAFFAR4
SCHEMBL14766145 0.91 S1PR1 (0.39) FFAR1PPARDNAAAS1PR1S1PR3
SCHEMBL14767295 0.91 FFAR1 (0.33) FFAR1PPARDNAAAS1PR1S1PR3

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