SCHEMBL2622290

SCHEMBL2622290

CSc1ncc2c(C)cc(=O)n(C3CCCC3)c2n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 17/20 0.53
CCND1 P24385 17/20 0.53
CCND2 P30279 17/20 0.53
CCND3 P30281 17/20 0.53
NUAK1 O60285 2/20 0.52
MARK3 P27448 1/20 0.52
MARK2 Q7KZI7 1/20 0.52
MARK4 Q96L34 1/20 0.52
NUAK2 Q9H093 1/20 0.52
MARK1 Q9P0L2 1/20 0.52
CCNB2 O95067 1/20 0.52
CDK1 P06493 1/20 0.52
CCNB1 P14635 1/20 0.52
CCNB3 Q8WWL7 1/20 0.52
FGFR1 P11362 1/20 0.51
FGFR2 P21802 1/20 0.51
FGFR4 P22455 1/20 0.51
FGFR3 P22607 1/20 0.51
PIK3CA P42336 2/20 0.39
TNF P01375 1/20 0.39

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
SCHEMBL29507738 1.00 CDK4 (0.53) CDK4CCND1CCND2CCND3NUAK1
SCHEMBL30878784 0.86 CDK4 (0.41) CDK4CCND1CCND2CCND3NUAK1
SCHEMBL1226050 0.86 CDK4 (0.41) CDK4CCND1CCND2CCND3NUAK1
SCHEMBL7076399 0.86 CDK4 (0.52) CDK4CCND1CCND2CCND3NUAK1
SCHEMBL1227335 0.86 CDK4 (0.41) CDK4CCND1CCND2CCND3NUAK1
SCHEMBL1227255 0.86 CDK4 (0.41) CDK4CCND1CCND2CCND3NUAK1
SCHEMBL1226546 0.86 CDK4 (0.41) CDK4CCND1CCND2CCND3NUAK1
SCHEMBL1227274 0.85 CDK4 (0.42) CDK4CCND1CCND2CCND3NUAK1
SCHEMBL1226187 0.85 CDK4 (0.42) CDK4CCND1CCND2CCND3NUAK1
SCHEMBL22585849 0.84 CDK4 (0.40) CDK4CCND1CCND2CCND3NUAK1

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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230042936-A1 PYRIDO[2,3-d]PYRIMIDIN-7(8H)-ONES AS CDK INHIBITORS FUNDACION DEL SECTOR PUBLICO ESTATAL CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS CARLOS III (F.S.P. CNIO) (ES) 2023-02-09 US disclosed
WO-2021183994-A1 PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES AS CDK INHIBITORS PROSENESTAR LLC (US) 2021-09-16 WO disclosed
CN-106632313-B Important intermediate of anticancer drug palbociclib and synthesis process 上海贤鼎生物科技有限公司 2021-04-09 CN disclosed
WO-2021003314-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS NUVATION BIO INC. (US) 2021-01-07 WO disclosed
EP-3718560-A2 CYCLIN DEPENDENT KINASE INHIBITORS AND METHODS OF USE The University of North Carolina at Chapel Hill (US) 2020-10-07 EP disclosed
EP-3406260-B1 CYCLIN DEPENDENT KINASE INHIBITORS AND METHODS OF USE UNIV NORTH CAROLINA CHAPEL HILL (US) 2020-09-23 EP disclosed
EP-3025724-B1 CYCLIN DEPENDENT KINASE INHIBITORS AND METHODS OF USE UNIV NORTH CAROLINA CHAPEL HILL (US) 2018-07-11 EP disclosed
US-9808461-B2 Protection of renal tissues from ischemia through inhibition of the proliferative kinases CDK4 and CDK6 THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2017-11-07 US disclosed
US-9808461-B2 Protection of renal tissues from ischemia through inhibition of the proliferative kinases CDK4 and CDK6 THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2017-11-07 US disclosed
US-20170224819-A1 Therapeutic Combinations of a BTK Inhibitor, a PI3K Inhibitor, a JAK-2 Inhibitor, and/or a CDK 4/6 Inhibitor ACERTA PHARMA BV (NL) 2017-08-10 US disclosed
US-7208489-B2 Inhibitors of cyclin-dependent kinases 4 (cdk4); treating proliferative disorders such as cancer; salt of 6-Acetyl-8-cyclopentyl-5-methyl-2-(5-piperazin-1-yl-pyridin-2-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one for example WARNER-LAMBERT COMPANY (US) 2007-04-24 US disclosed
US-20060047118-A1 New pteridinones as PLK inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-03-02 US disclosed
EP-1470124-B1 2-(PYRIDIN-2-YLAMINO)-PYRIDO 2,3-d]PYRIMIDIN-7-ONES WARNER LAMBERT CO (US) 2005-12-28 EP disclosed
US-6936612-B2 2-(Pyridin-2-ylamino)-pyrido[2,3-d]pyrimidin-7-ones WARNER-LAMBERT COMPANY (US) 2005-08-30 US disclosed
US-20050137214-A1 2-(Pyridin-2-ylamino)-pyrido [2,3-D]pyrimidin-7-ones WARNER-LAMBERT COMPANY 2005-06-23 US disclosed
EP-1470124-A1 2-(PYRIDIN-2-YLAMINO)-PYRIDO 2,3-d]PYRIMIDIN-7-ONES Warner-Lambert Company LLC (US) 2004-10-27 EP disclosed
US-20030149001-A1 2-(Pyridin-2-ylamino)-pyrido[2,3-d]pyrimidin-7-ones BARVIAN MARK (US) 2003-08-07 US disclosed
WO-2003062236-A1 2-(PYRIDIN-2-YLAMINO)-PYRIDO[2,3d]PYRIMIDIN-7-ONES WARNER-LAMBERT COMPANY LLC (US) 2003-07-31 WO disclosed
EP-1268476-A1 5-ALKYLPYRIDO[2,3-D]PYRIMIDINES TYROSINE KINASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2003-01-02 EP disclosed
WO-2001070741-A1 5-ALKYLPYRIDO[2,3-D]PYRIMIDINES TYROSINE KINASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-09-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030149001-A1 2-(Pyridin-2-ylamino)-pyrido[2,3-d]pyrimidin-7-ones CDK4, CDK2, CDK1 CDK4 1/4885CCND1 27/4885CCND2 33/4885
US-20170224819-A1 Therapeutic Combinations of a BTK Inhibitor, a PI3K Inhibitor, a JAK-2 Inhibitor, and/or a CDK 4/6 Inhibitor BTK, CDK6, CDK4 CDK4 3/4885CCND1 73/4885CCND2 51/4885
US-20050137214-A1 2-(Pyridin-2-ylamino)-pyrido [2,3-D]pyrimidin-7-ones CDK4, CDK2, CDK3 CDK4 1/4885CCND1 34/4885CCND2 35/4885
US-20230042936-A1 PYRIDO[2,3-d]PYRIMIDIN-7(8H)-ONES AS CDK INHIBITORS CDK7, CDK8, CDK9 CDK4 7/4885CCND1 35/4885CCND2 38/4885
US-20060047118-A1 New pteridinones as PLK inhibitors PLK2, PLK4, PLK3 CDK4 42/4885CCND1 24/4885CCND2 63/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.