SCHEMBL14765892

SCHEMBL14765892

CCCCOc1ccc(C2CCC(CCc3ccc(C4CCC(OCCCC)CC4)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
PPARG P37231 1/20 0.30
PPARD Q03181 1/20 0.30
PPARA Q07869 1/20 0.30

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
SCHEMBL14766647 1.00 SCN9A (0.32) SCN9ACNR1CNR2PPARGPPARD
SCHEMBL14765906 0.97 SCN9A (0.32) SCN9ACNR1CNR2
SCHEMBL14766969 0.97 SCN9A (0.32) SCN9ACNR1CNR2
SCHEMBL14766310 0.97 SCN9A (0.30) SCN9A
SCHEMBL14766556 0.97 SCN9A (0.30) SCN9A
SCHEMBL14922511 0.94 SCN9A (0.35) SCN9ACNR1CNR2PPARGPPARD
SCHEMBL14766958 0.93
SCHEMBL14766200 0.93
SCHEMBL14766441 0.92 SCN9A (0.31) SCN9A
SCHEMBL14765719 0.92 SCN9A (0.31) SCN9A

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