SCHEMBL12595346

SCHEMBL12595346

Cc1cc(NC(=O)c2ccc3cc4n(c3n2)C(C)C(C)NC4=O)no1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ RPS6KA3 P51812 17/20 1.00
▸ RPS6KA2 Q15349 3/20 0.70

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
SCHEMBL1984989 1.00 RPS6KA3 (1.00) RPS6KA3RPS6KA2
SCHEMBL14973144 1.00 RPS6KA3 (1.00) RPS6KA3RPS6KA2
SCHEMBL14973146 1.00 RPS6KA3 (1.00) RPS6KA3RPS6KA2
SCHEMBL1984987 1.00 RPS6KA3 (1.00) RPS6KA3RPS6KA2
SCHEMBL1983889 0.85 RPS6KA3 (1.00) RPS6KA3RPS6KA2
SCHEMBL14973094 0.85 RPS6KA3 (1.00) RPS6KA3RPS6KA2
SCHEMBL1982770 0.84 RPS6KA3 (1.00) RPS6KA3RPS6KA2
SCHEMBL14972909 0.84 RPS6KA3 (1.00) RPS6KA3RPS6KA2
SCHEMBL1982771 0.84 RPS6KA3 (1.00) RPS6KA3RPS6KA2
SCHEMBL14972908 0.84 RPS6KA3 (1.00) RPS6KA3RPS6KA2

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
WO-2011071725-A1 HETEROCYCLIC COMPOUNDS CONTAINING A PYRROLOPYRIDINE OR BENZIMIDAZOLE CORE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-06-16 — — WO disclosed
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