SCHEMBL8936027

SCHEMBL8936027

CCCCCc1ccc(-c2ccc(-c3ccc(C4=CCC(CCC)CC4)cc3F)cc2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.35
ESR2 Q92731 1/20 0.34
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31

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
SCHEMBL8935958 0.99 RARB (0.37) RARBESR2MMP2MMP3
SCHEMBL8935974 0.99 RARB (0.37) RARBESR2MMP2MMP3
SCHEMBL8935977 0.99 RARB (0.37) RARBESR2MMP2MMP3
SCHEMBL8935947 0.99 RARB (0.37) RARBESR2MMP2MMP3
SCHEMBL8935951 0.99 RARB (0.37) RARBESR2MMP2MMP3
SCHEMBL8935955 0.97 ESR2 (0.35) RARBESR2MMP2MMP3
SCHEMBL8936211 0.96 RARB (0.35) RARBESR2
SCHEMBL8936309 0.95 RARB (0.37) RARBESR2
SCHEMBL8936220 0.95 RARB (0.37) RARBESR2
SCHEMBL8936337 0.95 RARB (0.37) RARBESR2

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