SCHEMBL8935969

SCHEMBL8935969

CCC/C=C\Oc1ccc(-c2ccc(-c3ccc(C4CCC(CCCCCCCCCC)CC4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL8963469 0.97 GAA (0.31) GAAMAPT
SCHEMBL8935779 0.92 GAA (0.31) GAAMAPT
SCHEMBL8963371 0.90 GAA (0.30) GAAMAPT
SCHEMBL8961707 0.89 FFAR4 (0.30)
SCHEMBL15723078 0.87 GAA (0.30) GAAMAPT
SCHEMBL15723101 0.87 ALDH1A1 (0.31) MAPT
SCHEMBL8934172 0.87 CYP3A4 (0.32)
SCHEMBL15723081 0.86
SCHEMBL19985613 0.85 GAA (0.35) GAAMAPT
SCHEMBL19985617 0.85 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