SCHEMBL8934813

SCHEMBL8934813

C=CCCCOc1ccc(-c2ccc(-c3ccc(C4CCC(C)CC4)c(F)c3)cc2)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.34
FFAR4 Q5NUL3 3/20 0.32
HRH3 Q9Y5N1 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
PTGDR Q13258 1/20 0.30
PTGDR2 Q9Y5Y4 1/20 0.30
ALOX5AP P20292 1/20 0.30
FEN1 P39748 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
SCHEMBL8934794 0.96 FFAR4 (0.32) KDM4EFFAR4GABRA1GABRB2PTGDR
SCHEMBL13000129 0.91 KDM4E (0.34) KDM4EGABRA1GABRB2ALDH1A1MAPK1
SCHEMBL8934786 0.90 HTR2C (0.36) FFAR4PTGDRPTGDR2ALOX5APFEN1
SCHEMBL13000538 0.88 FFAR4 (0.31) FFAR4
SCHEMBL13000254 0.88 KDM4E (0.33) KDM4EGABRA1GABRB2ALOX5APFEN1
SCHEMBL8934838 0.87 FFAR4 (0.32) FFAR4PTGDRPTGDR2ALOX5APFEN1
SCHEMBL12999822 0.87 HTR2C (0.35) FFAR4PTGDRPTGDR2ALOX5APFEN1
SCHEMBL8956563 0.86 FPR2 (0.30)
SCHEMBL9020651 0.86 NAAA (0.36) KDM4EFFAR4ALDH1A1MAPK1PTGDR
SCHEMBL8941867 0.86

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