SCHEMBL14767003

SCHEMBL14767003

CCCCOc1ccc(COc2ccc(-c3ccc(C4CCC(OCCCC)CC4)c(F)c3F)cc2)cc1F

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 12/20 0.38
FFAR1 O14842 9/20 0.38
FFAR4 Q5NUL3 2/20 0.37
PPARA Q07869 5/20 0.36
PPARG P37231 2/20 0.35
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
NAAA Q02083 1/20 0.35
HTR6 P50406 1/20 0.34
GYS1 P13807 2/20 0.34

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
SCHEMBL14766567 0.97 PPARD (0.39) PPARDFFAR1FFAR4PPARAPPARG
SCHEMBL14766598 0.97 PPARD (0.37) PPARDFFAR1FFAR4PPARAPPARG
SCHEMBL14767111 0.94 FFAR1 (0.38) PPARDFFAR1FFAR4PPARANAAA
SCHEMBL14766846 0.94 NAAA (0.38) PPARDFFAR1FFAR4PPARAALOX5AP
SCHEMBL14766790 0.94 GABRA1 (0.35) PPARDFFAR1FFAR4PPARAPPARG
SCHEMBL14766837 0.93 GABRA1 (0.35) PPARDFFAR1FFAR4PPARAPPARG
SCHEMBL14766637 0.93 FFAR1 (0.37) PPARDFFAR1FFAR4PPARAALOX5AP
SCHEMBL14767037 0.92 FFAR1 (0.38) PPARDFFAR1FFAR4PPARANAAA
SCHEMBL14766964 0.92 FFAR1 (0.39) PPARDFFAR1FFAR4PPARANAAA
SCHEMBL14766989 0.92 NAAA (0.37) PPARDFFAR1FFAR4PPARAPPARG

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