SCHEMBL14765978

SCHEMBL14765978

CCCCOc1ccc(-c2ccc(OC(=O)C3CCC(c4ccc(OCC)cc4F)CC3)c(F)c2F)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 5/20 0.46
FFAR1 O14842 3/20 0.46
PPARD Q03181 5/20 0.40
RARA P10276 1/20 0.38
RARB P10826 1/20 0.38
CRBN Q96SW2 1/20 0.37
MCL1 Q07820 1/20 0.37
PTPN11 Q06124 1/20 0.36
FAAH O00519 1/20 0.36
SCN9A Q15858 1/20 0.35
HPGD P15428 1/20 0.35
PPARA Q07869 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL14766109 0.98 FFAR4 (0.43) FFAR4FFAR1PPARDRARARARB
SCHEMBL14766206 0.96 FFAR4 (0.42) FFAR4FFAR1PPARDRARARARB
SCHEMBL14766466 0.95 FFAR1 (0.43) FFAR4FFAR1PPARDHPGD
SCHEMBL14767134 0.94 FFAR1 (0.43) FFAR4FFAR1PPARDRARARARB
SCHEMBL12737361 0.94 FFAR4 (0.39) FFAR4FFAR1PPARDRARARARB
SCHEMBL14766161 0.92 FFAR4 (0.39) FFAR4FFAR1PPARDRARARARB
SCHEMBL12737363 0.92 PTPN11 (0.38) FFAR4FFAR1PPARDRARARARB
SCHEMBL14765973 0.92 FFAR4 (0.38) FFAR4FFAR1PPARDRARARARB
SCHEMBL12737366 0.91 PTPN11 (0.39) FFAR4FFAR1PPARDCRBNMCL1
SCHEMBL12737365 0.91 PTPN11 (0.39) FFAR4FFAR1PPARDCRBNMCL1

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