SCHEMBL8969153

SCHEMBL8969153

CCCCCCCCCC1CCC(CCc2ccc(-c3ccc(-c4ccc(OCC)c(F)c4F)cc3)c(F)c2F)OC1

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 5/20 0.30
SLC6A4 P31645 5/20 0.30
SLC6A3 Q01959 5/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2B Q13224 1/20 0.30
CTSL P07711 1/20 0.30
CTSS P25774 1/20 0.30
CTSK P43235 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
SCHEMBL8969170 1.00 SLC6A2 (0.30) SLC6A2SLC6A4SLC6A3GRIN1GRIN2B
SCHEMBL8969132 0.92 NAAA (0.35) SLC6A2SLC6A4SLC6A3
SCHEMBL8969304 0.91 CNR2 (0.34) SLC6A2SLC6A4SLC6A3
SCHEMBL8969298 0.91 CNR2 (0.34) SLC6A2SLC6A4SLC6A3
SCHEMBL8970556 0.89 GRIN1 (0.32) SLC6A2SLC6A4SLC6A3GRIN1GRIN2B
SCHEMBL8970844 0.89 GRIN1 (0.32) SLC6A2SLC6A4SLC6A3GRIN1GRIN2B
SCHEMBL8970531 0.89 GRIN1 (0.32) SLC6A2SLC6A4SLC6A3GRIN1GRIN2B
SCHEMBL8969709 0.89 SLC6A2 (0.34) SLC6A2SLC6A4SLC6A3
SCHEMBL8969201 0.87 RARB (0.38) SLC6A2SLC6A4SLC6A3GRIN1GRIN2B
SCHEMBL8969606 0.87 GRIN1 (0.32) SLC6A2SLC6A4SLC6A3GRIN1GRIN2B

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