SCHEMBL13309452

SCHEMBL13309452

Cc1ccccc1-c1cc(Nc2cccc(O)c2)n2ncc(Br)c2n1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 8/20 0.61
▸ CDK2 P24941 7/20 0.44
▸ CCNE1 P24864 1/20 0.40
▸ CCNA2 P20248 1/20 0.40
▸ CCNA1 P78396 1/20 0.40
▸ TP53 P04637 1/20 0.39
▸ SYK P43405 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ CSNK2A1 P68400 1/20 0.38

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
SCHEMBL13885040 0.88 GSK3B (0.66) GSK3BCDK2CCNE1CCNA2CCNA1
SCHEMBL13998528 0.84 GSK3B (0.62) GSK3BCDK2CCNE1
SCHEMBL11931056 0.76 GSK3B (0.76) GSK3BCDK2CCNE1CCNA2CCNA1
SCHEMBL13309048 0.75 GSK3B (0.66) GSK3BCDK2
SCHEMBL13309213 0.75 GSK3B (0.58) GSK3BCDK2
SCHEMBL13309390 0.75 GSK3B (0.62) GSK3BCDK2CCNE1CCNA2CCNA1
SCHEMBL11936842 0.74 GSK3B (0.51) GSK3BCDK2CCNE1CCNA2CCNA1
SCHEMBL13146372 0.74 GSK3B (0.55) GSK3BCDK2CCNE1CCNA2CCNA1
SCHEMBL12954309 0.74 GSK3B (0.56) GSK3BCDK2CCNE1CCNA2CCNA1
SCHEMBL13993125 0.74 CDK2 (0.67) GSK3BCDK2CCNA2CCNA1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1934224-B1 PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS FOR THE TREATMENT OF CANCER SCHERING CORP (US) 2010-06-09 — — EP disclosed
US-7514442-B2 Trisubstituted 4-aminopyrazolopyrimidines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2009-04-07 — — US disclosed
US-7514442-B2 Trisubstituted 4-aminopyrazolopyrimidines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2009-04-07 — — US disclosed
EP-1534712-B1 PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AS CYCLIN DEPENDENT KINASE INHIBITORS SCHERING CORP (US) 2007-05-16 — — EP disclosed
WO-2007044420-A1 PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS FOR THE TREATMENT OF CANCER SCHERING CORPORATION (US) 2007-04-19 — — WO disclosed
US-7205308-B2 Trisubstituted 7-aminopyrazolopyrimidines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2007-04-17 — — US disclosed
US-7205308-B2 Trisubstituted 7-aminopyrazolopyrimidines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2007-04-17 — — US disclosed
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