SCHEMBL8970766

SCHEMBL8970766

CCCCCCOc1ccc(-c2ccc(-c3ccc(COC4OCC(CCCCC)CO4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.32
CNR1 P21554 6/20 0.32
NAAA Q02083 1/20 0.30
PTPN11 Q06124 2/20 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
SCHEMBL8970751 0.91 NAAA (0.39) CNR2CNR1NAAAPTPN11
SCHEMBL8969882 0.86 CNR2 (0.34) CNR2CNR1
SCHEMBL8969591 0.86 CNR2 (0.34) CNR2CNR1
SCHEMBL8969780 0.86 CNR2 (0.34) CNR2CNR1
SCHEMBL8971025 0.85 NAAA (0.32) NAAAPTPN11
SCHEMBL8970853 0.85 NAAA (0.32) NAAAPTPN11
SCHEMBL8971099 0.84 RARB (0.33) CNR2PTPN11
SCHEMBL8972175 0.83 SPHK2 (0.32)
SCHEMBL8971110 0.83 NAAA (0.33) NAAA
SCHEMBL8970930 0.83 NAAA (0.33) NAAA

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