SCHEMBL13998482

SCHEMBL13998482

Brc1cnn2c(Nc3cccnc3)cc(-c3ccccc3)nc12

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 11/20 0.68
▸ CDK2 P24941 10/20 0.66
▸ CCNE1 P24864 6/20 0.66
▸ CHEK1 O14757 1/20 0.55
▸ CCNA2 P20248 1/20 0.55
▸ CCNA1 P78396 1/20 0.55

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
SCHEMBL13998466 0.89 CDK2 (0.69) GSK3BCDK2CCNE1CHEK1CCNA2
SCHEMBL13998487 0.86 GSK3B (0.52) GSK3BCDK2CCNE1
SCHEMBL13998463 0.85 GSK3B (0.52) GSK3BCDK2CCNE1
SCHEMBL13998494 0.84 GSK3B (0.71) GSK3BCDK2CCNE1
SCHEMBL13998528 0.84 GSK3B (0.62) GSK3BCDK2CCNE1
SCHEMBL13998461 0.84 GSK3B (0.82) GSK3BCDK2CCNE1CCNA2CCNA1
SCHEMBL13998518 0.83 MAPT (0.55) GSK3BCDK2CCNE1
SCHEMBL13998499 0.83 GSK3B (0.71) GSK3BCDK2CCNE1
SCHEMBL13998516 0.83 GSK3B (0.57) GSK3BCDK2CCNE1
SCHEMBL13998500 0.83 AHR (0.50) GSK3BCDK2CCNE1

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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