SCHEMBL8969709

SCHEMBL8969709

CCCCCC1CCC(CCCCc2ccc(-c3ccc(-c4ccc(OCCC)c(F)c4F)cc3)c(F)c2F)CO1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 5/20 0.34
SLC6A4 P31645 5/20 0.34
SLC6A3 Q01959 5/20 0.34
CNR2 P34972 6/20 0.31
CNR1 P21554 4/20 0.31
FPR2 P25090 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
SCHEMBL8969298 0.96 CNR2 (0.34) SLC6A2SLC6A4SLC6A3CNR2CNR1
SCHEMBL8969304 0.96 CNR2 (0.34) SLC6A2SLC6A4SLC6A3CNR2CNR1
SCHEMBL8969254 0.90 CNR2 (0.35) SLC6A2SLC6A4SLC6A3CNR2CNR1
SCHEMBL8969153 0.89 SLC6A2 (0.30) SLC6A2SLC6A4SLC6A3
SCHEMBL8969170 0.89 SLC6A2 (0.30) SLC6A2SLC6A4SLC6A3
SCHEMBL8969239 0.89 CNR2 (0.35) SLC6A2SLC6A4SLC6A3CNR2CNR1
SCHEMBL8970734 0.88 FPR2 (0.32) FPR2
SCHEMBL8969516 0.87 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3CNR2
SCHEMBL12759873 0.86 CHRM2 (0.33) FPR2
SCHEMBL12759761 0.85 CHRM2 (0.33) FPR2

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