SCHEMBL14766989

SCHEMBL14766989

CCCCOc1ccc(-c2ccc(C3CCC(OCc4ccc(OCC)c(F)c4)CC3)c(F)c2F)cc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.37
RARA P10276 1/20 0.37
RARB P10826 1/20 0.37
FFAR1 O14842 7/20 0.36
PPARD Q03181 7/20 0.36
FFAR4 Q5NUL3 3/20 0.36
BRD4 O60885 1/20 0.35
FAAH O00519 1/20 0.35
PPARA Q07869 2/20 0.34
PPARG P37231 1/20 0.34
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
DRD4 P21917 2/20 0.33
SIGMAR1 Q99720 1/20 0.33
PTPN11 Q06124 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 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
SCHEMBL14766846 0.97 NAAA (0.38) NAAARARARARBFFAR1PPARD
SCHEMBL14766637 0.95 FFAR1 (0.37) NAAARARARARBFFAR1PPARD
SCHEMBL14766567 0.95 PPARD (0.39) NAAAFFAR1PPARDFFAR4PPARA
SCHEMBL14766979 0.94 FFAR1 (0.41) NAAAFFAR1PPARDFFAR4PPARA
SCHEMBL14767003 0.92 PPARD (0.38) NAAAFFAR1PPARDFFAR4PPARA
SCHEMBL14766852 0.91 GABRA1 (0.36) NAAARARARARBFFAR1PPARD
SCHEMBL14766598 0.91 PPARD (0.37) NAAAFFAR1PPARDFFAR4PPARA
SCHEMBL12740331 0.91 RARB (0.37) NAAARARARARBFFAR4ALOX5AP
SCHEMBL12740337 0.91 SIGMAR1 (0.40) NAAAFFAR1PPARDFFAR4ALOX5AP
SCHEMBL14766954 0.91 GABRA1 (0.35) NAAARARARARBFFAR1PPARD

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