SCHEMBL3249845

SCHEMBL3249845

COCCCNS(=O)(=O)c1ccc(Nc2nccc(-c3ccnc4[nH]c(C)cc34)n2)cc1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 10/20 0.57
CDK4 P11802 4/20 0.57
CDK1 P06493 1/20 0.57
IKBKB O14920 8/20 0.55
CHUK O15111 4/20 0.55
ROCK1 Q13464 1/20 0.53
BRAF P15056 1/20 0.45
CCNT1 O60563 1/20 0.43
CDK9 P50750 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
SCHEMBL3253045 0.95 CDK2 (0.61) CDK2CDK4CDK1IKBKBCHUK
SCHEMBL3251653 0.86 CDK2 (0.58) CDK2CDK4CDK1IKBKBCHUK
SCHEMBL3250044 0.81 CDK1 (0.59) CDK2CDK4CDK1
SCHEMBL3247683 0.80 CDK2 (0.61) CDK2CDK4CDK1IKBKBCHUK
SCHEMBL6593918 0.77 CDK2 (0.90) CDK2CDK4CDK1CCNT1CDK9
SCHEMBL6599298 0.75 CDK2 (0.67) CDK2CDK4CDK1IKBKB
SCHEMBL6106428 0.75 CDK2 (0.90) CDK2CDK4CDK1CCNT1CDK9
SCHEMBL4817051 0.75 CDK2 (0.72) CDK2CDK4CDK1IKBKB
SCHEMBL6595584 0.75 CDK2 (0.78) CDK2CDK4CDK1
SCHEMBL6295111 0.75 CDK2 (0.68) CDK2CDK4CDK1IKBKB

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
EP-1896470-B1 PYRROLOPYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-05-26 EP claimed
US-20080300267-A1 Compounds and Compositions as Protein Kinase Inhibitors TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-12-04 US claimed
EP-1896470-A2 PYRROLOPYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2008-03-12 EP claimed
WO-2006124863-A2 PYRROLOPYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-11-23 WO claimed
EP-1896470-B1 PYRROLOPYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-05-26 EP disclosed
US-20080300267-A1 Compounds and Compositions as Protein Kinase Inhibitors TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-12-04 US disclosed
US-20080300267-A1 Compounds and Compositions as Protein Kinase Inhibitors TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-12-04 US disclosed
US-20080300267-A1 Compounds and Compositions as Protein Kinase Inhibitors TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-12-04 US disclosed
EP-1896470-A2 PYRROLOPYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2008-03-12 EP disclosed
WO-2006124863-A2 PYRROLOPYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-11-23 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 (1 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-20080300267-A1 Compounds and Compositions as Protein Kinase Inhibitors ERBB2, JAK2, AURKC CDK2 9/4885CDK4 129/4885CDK1 38/4885

“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.