SCHEMBL14766748

SCHEMBL14766748

CCCCOc1ccc(COc2ccc(-c3ccc(-c4ccc(OCCC)cc4)c(F)c3F)cc2)cc1F

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 8/20 0.46
PPARD Q03181 6/20 0.46
FAAH O00519 1/20 0.42
PPARA Q07869 3/20 0.41
PPARG P37231 1/20 0.41
S1PR1 P21453 2/20 0.40
RARA P10276 1/20 0.40
RARB P10826 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
MGAM O43451 4/20 0.38
GAA P10253 4/20 0.38
SI P14410 4/20 0.38
MGAM2 Q2M2H8 4/20 0.38
S1PR2 O95136 1/20 0.38
S1PR3 Q99500 1/20 0.38
LPAR2 Q9HBW0 1/20 0.38
PTPN11 Q06124 1/20 0.38

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
SCHEMBL14766898 0.98 FFAR1 (0.43) FFAR1PPARDFAAHPPARAPPARG
SCHEMBL14767148 0.94 FFAR1 (0.48) FFAR1PPARDFAAHS1PR1RARA
SCHEMBL14766999 0.93 FFAR1 (0.46) FFAR1PPARDFAAHPPARAPPARG
SCHEMBL12740533 0.92 FFAR1 (0.42) FFAR1PPARDFAAHPPARAPPARG
SCHEMBL14766750 0.92 FFAR1 (0.45) FFAR1PPARDFAAHS1PR1RARA
SCHEMBL14766695 0.91 S1PR1 (0.44) FFAR1PPARDFAAHS1PR1RARA
SCHEMBL14767244 0.91 FFAR1 (0.46) FFAR1PPARDFAAHS1PR1RARA
SCHEMBL12740535 0.90 FFAR1 (0.41) FFAR1PPARDFAAHPPARAPPARG
SCHEMBL14767000 0.89 CNR2 (0.43) FFAR1PPARDFAAHPPARAPPARG
SCHEMBL14766942 0.89 CNR2 (0.43) FFAR1PPARDFAAHPPARAPPARG

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