SCHEMBL11016463

SCHEMBL11016463

CCSc1ccc(-c2nc3ccc(C(N)=O)cc3[nH]2)c(OC)c1

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 20/20 0.66

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
SCHEMBL11016890 0.92 CHEK2 (0.63) CHEK2
SCHEMBL11016458 0.92 CHEK2 (0.55) CHEK2
SCHEMBL11017902 0.91 CHEK2 (0.53) CHEK2
SCHEMBL11019652 0.90 CHEK2 (0.52) CHEK2
SCHEMBL11022051 0.89 CHEK2 (0.66) CHEK2
SCHEMBL11016885 0.84 CHEK2 (0.53) CHEK2
SCHEMBL11017897 0.82 PDE4A (0.44) CHEK2
SCHEMBL11019650 0.82 CHEK2 (0.43) CHEK2
SCHEMBL11022048 0.80 CHEK2 (0.55) CHEK2
SCHEMBL11020242 0.79 CHEK2 (0.58) CHEK2

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-0148431-A1 Benzimidazoles, their preparation, and medicaments containing these compounds Dr. Karl Thomae GmbH (DE) 1985-07-17 EP disclosed