SCHEMBL11020242

SCHEMBL11020242

C#CCOc1ccc(-c2nc3ccc(C(N)=O)cc3[nH]2)c(OC)c1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 20/20 0.58

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
SCHEMBL11020236 0.92 CHEK2 (0.48) CHEK2
SCHEMBL11018206 0.91 CHEK2 (0.61) CHEK2
SCHEMBL11019250 0.91 CHEK2 (0.53) CHEK2
SCHEMBL11018770 0.90 KDM4E (0.47) CHEK2
SCHEMBL11020063 0.89 CHEK2 (0.56) CHEK2
SCHEMBL11018835 0.85 MEN1 (0.47) CHEK2
SCHEMBL11020833 0.85 CHEK2 (0.58) CHEK2
SCHEMBL11018199 0.84 CHEK2 (0.51) CHEK2
SCHEMBL11019245 0.83 CHEK2 (0.44) CHEK2
SCHEMBL11018042 0.83 CHEK2 (0.48) 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