SCHEMBL4715599

SCHEMBL4715599

CCOc1cccc(-c2cncc3nc(-c4nonc4N)n(CC)c23)c1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RPS6KA5 O75582 14/20 0.58
ROCK1 Q13464 13/20 0.52
RPS6KB1 P23443 3/20 0.51
RPS6KA1 Q15418 3/20 0.51
DYRK1A Q13627 2/20 0.51
CDK2 P24941 1/20 0.51
AKT1 P31749 6/20 0.51
AKT2 P31751 5/20 0.51
AKT3 Q9Y243 5/20 0.51
PRKACA P17612 1/20 0.48
GSK3B P49841 1/20 0.48

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
Hydrochloric Acid SCHEMBL4718154 0.99 RPS6KA5 (0.57) RPS6KA5ROCK1RPS6KB1RPS6KA1DYRK1A
SCHEMBL4716625 0.89 RPS6KA5 (0.54) RPS6KA5ROCK1RPS6KB1RPS6KA1DYRK1A
Hydrochloric Acid SCHEMBL4718516 0.88 RPS6KA5 (0.53) RPS6KA5ROCK1RPS6KB1RPS6KA1DYRK1A
SCHEMBL4714480 0.88 RPS6KA5 (0.62) RPS6KA5ROCK1RPS6KB1RPS6KA1DYRK1A
Hydrochloric Acid SCHEMBL4714602 0.87 RPS6KA5 (0.61) RPS6KA5ROCK1RPS6KB1RPS6KA1DYRK1A
SCHEMBL4718805 0.86 RPS6KA5 (0.67) RPS6KA5ROCK1RPS6KB1RPS6KA1DYRK1A
SCHEMBL4826725 0.86 RPS6KA5 (0.59) RPS6KA5ROCK1RPS6KB1RPS6KA1DYRK1A
SCHEMBL5461824 0.85 RPS6KA5 (0.58) RPS6KA5ROCK1RPS6KB1RPS6KA1DYRK1A
Hydrochloric Acid SCHEMBL4718591 0.84 RPS6KA5 (0.57) RPS6KA5ROCK1RPS6KB1RPS6KA1DYRK1A
SCHEMBL4714604 0.84 RPS6KA5 (0.57) RPS6KA5ROCK1RPS6KB1RPS6KA1DYRK1A

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-1490367-B1 IMIDAZOPYRIDINE DERIVATIVES AS KINASE INHIBITORS GLAXO GROUP LTD (GB) 2008-07-23 EP disclosed