SCHEMBL3247308

SCHEMBL3247308

COc1cccc(Nc2nccc(-c3ccnc4[nH]ccc34)n2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 5/20 0.65
PIK3CA P42336 4/20 0.65
PIK3CB P42338 4/20 0.65
EGFR P00533 1/20 0.58
GSK3B P49841 6/20 0.58
CDK2 P24941 3/20 0.58
DYRK1A Q13627 2/20 0.58
CDK4 P11802 1/20 0.58
JAK2 O60674 2/20 0.57
RET P07949 3/20 0.54
CDK1 P06493 2/20 0.54
CCNB2 O95067 1/20 0.54
CCNB1 P14635 1/20 0.54
CCNB3 Q8WWL7 1/20 0.54
SYK P43405 3/20 0.53
MTOR P42345 1/20 0.52
SMG1 Q96Q15 1/20 0.52
CDK5 Q00535 2/20 0.51
ROCK1 Q13464 2/20 0.50
CDC7 O00311 1/20 0.50

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
SCHEMBL3251716 0.90 SYK (0.56) PIK3CGPIK3CAPIK3CBGSK3BCDK2
SCHEMBL3246779 0.86 CDK1 (0.74) PIK3CGPIK3CAPIK3CBEGFRGSK3B
SCHEMBL3251689 0.84 CCNB2 (0.51) PIK3CGPIK3CAPIK3CBGSK3BCDK2
SCHEMBL3246773 0.84 NUDT1 (0.61) PIK3CGPIK3CAPIK3CBCDK2CDK4
SCHEMBL13357453 0.83 CDK1 (0.55) PIK3CGPIK3CAPIK3CBEGFRGSK3B
SCHEMBL27116598 0.81 PIK3CG (0.83) PIK3CGPIK3CAPIK3CBEGFRGSK3B
SCHEMBL3243466 0.80 RET (0.54) PIK3CGPIK3CAPIK3CBGSK3BCDK2
SCHEMBL3247348 0.80 AURKA (0.58) GSK3BCDK2DYRK1ACDK4RET
SCHEMBL7993463 0.80 TNNI3K (0.60) PIK3CGPIK3CAPIK3CBEGFRROCK1
SCHEMBL12723008 0.79 EGFR (0.59) PIK3CGPIK3CAPIK3CBEGFRGSK3B

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 11 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
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 PIK3CG 89/4885PIK3CA 67/4885PIK3CB 61/4885

“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.