SCHEMBL13998536

SCHEMBL13998536

Brc1cnn2c(Nc3cccnc3)cc(NC3CCCCC3)nc12

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 16/20 0.54
▸ CDK2 P24941 7/20 0.54
▸ MAPKAPK2 P49137 2/20 0.53
▸ CSNK2B P67870 1/20 0.45
▸ CSNK2A1 P68400 1/20 0.42

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
SCHEMBL13998623 0.99 GSK3B (0.55) GSK3BCDK2MAPKAPK2CSNK2BCSNK2A1
SCHEMBL13998535 0.84 GSK3B (0.70) GSK3BCDK2
SCHEMBL13998510 0.84 GSK3B (0.46) GSK3BCDK2MAPKAPK2
SCHEMBL13998539 0.84 GSK3B (0.46) GSK3BCDK2MAPKAPK2
SCHEMBL13118315 0.83 GSK3B (0.74) GSK3BCDK2
SCHEMBL13998473 0.82 GSK3B (0.52) GSK3BCDK2
SCHEMBL12953403 0.82 GSK3B (0.73) GSK3BCDK2
SCHEMBL13309212 0.81 CDK2 (0.58) GSK3BCDK2MAPKAPK2CSNK2B
SCHEMBL12954157 0.80 GSK3B (0.73) GSK3BCDK2
SCHEMBL11931138 0.79 GSK3B (0.45) GSK3BCDK2MAPKAPK2CSNK2BCSNK2A1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7470695-B2 N-heteroaryl pyrazolopyrimidines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2008-12-30 — — US disclosed
US-7470695-B2 N-heteroaryl pyrazolopyrimidines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2008-12-30 — — US disclosed
EP-1534709-B1 PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS SCHERING CORP (US) 2007-06-13 — — EP disclosed
WO-2007044401-A2 NOVEL PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS SCHERING CORPORATION (US) 2007-04-19 — — WO disclosed
US-7196092-B2 N-heteroaryl pyrazolopyrimidines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2007-03-27 — — US disclosed
US-7196092-B2 N-heteroaryl pyrazolopyrimidines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2007-03-27 — — US disclosed
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