SCHEMBL20005253

SCHEMBL20005253

COc1cc(OC(F)(F)c2c(F)cc(OC(F)(F)c3c(F)cc(-c4ccc(C)cc4F)cc3F)cc2F)cc(F)c1C#Cc1cc(F)c(F)c(F)c1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.32
CD274 Q9NZQ7 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
SCHEMBL19999604 0.96 ERN1 (0.33) ERN1CD274
SCHEMBL19999508 0.91
SCHEMBL20006840 0.87 ERN1 (0.37) ERN1
SCHEMBL20006839 0.87 ERN1 (0.36) ERN1CD274
SCHEMBL19999638 0.86 ERN1 (0.30) ERN1
SCHEMBL20005265 0.86
SCHEMBL20005249 0.83
SCHEMBL20004801 0.83
SCHEMBL19999507 0.83 ALOX5AP (0.31)
SCHEMBL12889476 0.83 GPR3 (0.35) ERN1

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
EP-3299439-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2018-03-28 EP disclosed