SCHEMBL8448774

SCHEMBL8448774

FCC/C=C/CCCC1CCC(c2ccc(-c3ccc(OC(F)(F)F)c(F)c3)cc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSK P43235 1/20 0.36
NAAA Q02083 1/20 0.36
GRM2 Q14416 2/20 0.32
S1PR1 P21453 1/20 0.31
EPHX2 P34913 3/20 0.31
SLC7A5 Q01650 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
SCHEMBL8448771 1.00 CTSK (0.36) CTSKNAAAGRM2S1PR1EPHX2
SCHEMBL8448786 1.00 CTSK (0.36) CTSKNAAAGRM2S1PR1EPHX2
SCHEMBL8448779 1.00 CTSK (0.36) CTSKNAAAGRM2S1PR1EPHX2
SCHEMBL8447961 0.85 CTSK (0.37) CTSKNAAAGRM2S1PR1EPHX2
SCHEMBL8447957 0.85 CTSK (0.37) CTSKNAAAGRM2S1PR1EPHX2
SCHEMBL8447941 0.85 CTSK (0.37) CTSKNAAAGRM2S1PR1EPHX2
SCHEMBL8447947 0.85 CTSK (0.37) CTSKNAAAGRM2S1PR1EPHX2
SCHEMBL9061876 0.84 CTSK (0.39) CTSKNAAAGRM2S1PR1EPHX2
SCHEMBL9061882 0.84 CTSK (0.39) CTSKNAAAGRM2S1PR1EPHX2
SCHEMBL9061975 0.83 CTSK (0.38) CTSKNAAAGRM2S1PR1EPHX2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0679707-B1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 1999-06-16 EP disclosed
US-5720899-A Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1998-02-24 US disclosed
US-5653911-A Liquid crystalline compound liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1997-08-05 US disclosed
EP-0679707-A1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element Chisso Corporation (JP) 1995-11-02 EP disclosed