SCHEMBL8963291

SCHEMBL8963291

CC/C=C\Cc1ccc(-c2ccc(-c3ccc(C4CCC(C5CCC(CCCCC)CC5)CC4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL8935710 0.97 GAA (0.32) GAAMAPT
SCHEMBL19985288 0.93 GAA (0.32) GAAMAPT
SCHEMBL8963283 0.92 GAA (0.32) GAAMAPT
SCHEMBL19985306 0.92 GAA (0.34) GAAMAPT
SCHEMBL19985611 0.92 GAA (0.34) GAAMAPT
SCHEMBL19985311 0.92 GAA (0.34) GAAMAPT
SCHEMBL19985301 0.92 GAA (0.34) GAAMAPT
SCHEMBL8961629 0.92 OPRL1 (0.31)
SCHEMBL19985616 0.91 GAA (0.35) GAAMAPT
SCHEMBL19985627 0.91 GAA (0.35) GAAMAPT

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