SCHEMBL13119511

SCHEMBL13119511

O=C(CN1C(=O)c2ccccc2C1=O)NCc1ccc(CNc2cc(-c3ccccc3Cl)nc3c(Br)cnn23)cc1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 12/20 0.68
▸ GSK3B P49841 6/20 0.63
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ CCNA2 P20248 1/20 0.49
▸ CCNA1 P78396 1/20 0.49
▸ CCNE1 P24864 4/20 0.45
▸ TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL13119408 0.95 CDK2 (0.64) CDK2GSK3BSMN1; SMN2CCNA2CCNA1
SCHEMBL13120270 0.90 CDK2 (0.59) CDK2GSK3BSMN1; SMN2CCNA2CCNA1
SCHEMBL13120060 0.88 CDK2 (0.58) CDK2GSK3BSMN1; SMN2CCNA2CCNA1
SCHEMBL13119440 0.87 CDK2 (0.72) CDK2GSK3BCCNA2CCNA1CCNE1
SCHEMBL13119456 0.86 CDK2 (0.70) CDK2GSK3BCCNA2CCNA1CCNE1
SCHEMBL13121585 0.86 CDK2 (0.75) CDK2GSK3BCCNA2CCNA1CCNE1
SCHEMBL13119518 0.86 CDK2 (0.75) CDK2GSK3BCCNA2CCNA1CCNE1
SCHEMBL13119422 0.85 CDK2 (0.69) CDK2GSK3BCCNA2CCNA1CCNE1
SCHEMBL14598871 0.85 CDK2 (0.69) CDK2GSK3BCCNA2CCNA1CCNE1
SCHEMBL13119512 0.85 CDK2 (0.69) CDK2GSK3BCCNA2CCNA1CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8673924-B2 Substituted pyrazolo[1,5-a]pyrimidines as cyclin dependent kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2014-03-18 — — US disclosed
US-8673924-B2 Substituted pyrazolo[1,5-a]pyrimidines as cyclin dependent kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2014-03-18 — — US disclosed
US-8586576-B2 Substituted pyrazolo[1,5-a]pyrimidines as cyclin dependent kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2013-11-19 — — US disclosed
US-8580782-B2 Substituted pyrazolo[1,5-a]pyrimidines as cyclin dependent kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2013-11-12 — — US disclosed
US-8580782-B2 Substituted pyrazolo[1,5-a]pyrimidines as cyclin dependent kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2013-11-12 — — US disclosed
US-7807683-B2 N-heteroaryl pyrazolopyrimidines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2010-10-05 — — US disclosed
US-7807683-B2 N-heteroaryl pyrazolopyrimidines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2010-10-05 — — US disclosed
EP-2194058-A1 Pyrazolopyrimidines suitable for the treatment of cancer diseases SCHERING CORPORATION (US) 2010-06-09 — — EP disclosed
US-7161003-B1 Pyrazolopyrimidines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2007-01-09 — — US disclosed
US-7161003-B1 Pyrazolopyrimidines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2007-01-09 — — US disclosed
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