SCHEMBL14766743

SCHEMBL14766743

CCOc1ccc(-c2ccc(CCc3ccc(C4=CCC(OCC)CC4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.34
NAAA Q02083 1/20 0.32
CCNT1 O60563 2/20 0.32
CDK9 P50750 2/20 0.32
CHKA P35790 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
SCHEMBL12718040 0.92 FFAR4 (0.34) FFAR4NAAACCNT1CDK9CHKA
SCHEMBL14766480 0.92 CCNT1 (0.33) FFAR4NAAACCNT1CDK9
SCHEMBL14766836 0.91 GABRA1 (0.33)
SCHEMBL14766771 0.91 CCNT1 (0.33) CCNT1CDK9
SCHEMBL14766198 0.91 NAAA (0.41) FFAR4NAAACCNT1CDK9
SCHEMBL14766238 0.90 GABRA1 (0.35) CCNT1CDK9
SCHEMBL14766981 0.90 CCNT1 (0.33) CCNT1CDK9
SCHEMBL12738653 0.88 FFAR4 (0.35) FFAR4CHKA
SCHEMBL12738638 0.87 FFAR4 (0.34) FFAR4CHKA
SCHEMBL14766662 0.87 S1PR1 (0.33) FFAR4NAAA

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