SCHEMBL14766898

SCHEMBL14766898

CCCCOc1ccc(-c2ccc(-c3ccc(OCc4ccc(OCCCC)c(F)c4)cc3)c(F)c2F)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 10/20 0.43
PPARD Q03181 8/20 0.43
FAAH O00519 1/20 0.43
PPARA Q07869 3/20 0.42
PPARG P37231 1/20 0.42
RARA P10276 1/20 0.41
RARB P10826 1/20 0.41
S1PR1 P21453 3/20 0.41
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
S1PR3 Q99500 2/20 0.39
S1PR2 O95136 1/20 0.39
LPAR2 Q9HBW0 1/20 0.39
PTPN11 Q06124 1/20 0.39
PTGES O14684 1/20 0.39

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
SCHEMBL14766748 0.98 FFAR1 (0.46) FFAR1PPARDFAAHPPARAPPARG
SCHEMBL14766999 0.95 FFAR1 (0.46) FFAR1PPARDFAAHPPARAPPARG
SCHEMBL12740533 0.94 FFAR1 (0.42) FFAR1PPARDFAAHPPARAPPARG
SCHEMBL14766750 0.94 FFAR1 (0.45) FFAR1PPARDFAAHRARARARB
SCHEMBL12740535 0.92 FFAR1 (0.41) FFAR1PPARDFAAHPPARAPPARG
SCHEMBL14767148 0.92 FFAR1 (0.48) FFAR1PPARDFAAHRARARARB
SCHEMBL14767000 0.91 CNR2 (0.43) FFAR1PPARDFAAHPPARAPPARG
SCHEMBL14766942 0.91 CNR2 (0.43) FFAR1PPARDFAAHPPARAPPARG
SCHEMBL12740539 0.91 S1PR1 (0.42) FFAR1PPARDPPARAPPARGRARB
SCHEMBL12740538 0.91 S1PR1 (0.42) FFAR1PPARDPPARAPPARGRARB

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