SCHEMBL8959831

SCHEMBL8959831

C=CCCCc1ccc(-c2ccc(-c3ccc(C4CCC(C5CCC(CCCCC)CC5)CC4)cc3F)cc2)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
RARB P10826 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
SCHEMBL8959994 0.97 RARB (0.32) FASNCYP3A4CYP2C9RARB
SCHEMBL8933725 0.97 CYP3A4 (0.32) FASNCYP3A4CYP2C9RARB
SCHEMBL8959896 0.96 CYP3A4 (0.31) FASNCYP3A4CYP2C9RARB
SCHEMBL8933880 0.95 RARB (0.33) FASNCYP3A4CYP2C9RARB
SCHEMBL8959506 0.94 RARB (0.32) FASNCYP3A4CYP2C9RARB
SCHEMBL8959515 0.93 RARB (0.34) FASNCYP3A4CYP2C9RARB
SCHEMBL8959514 0.93 RARB (0.34) FASNCYP3A4CYP2C9RARB
SCHEMBL8959511 0.93 RARB (0.34) FASNCYP3A4CYP2C9RARB
SCHEMBL8959494 0.93 RARB (0.34) FASNCYP3A4CYP2C9RARB
SCHEMBL8959500 0.93 RARB (0.34) FASNCYP3A4CYP2C9RARB

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-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed