SCHEMBL4267261

SCHEMBL4267261

NS(=O)(=O)c1ccc(Nc2nc(Nc3ccc4[nH]ncc4c3)nc3[nH]ncc23)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.64
MKNK1 Q9BUB5 1/20 0.56
CDK1 P06493 3/20 0.51
CCNT1 O60563 2/20 0.51
CCNB1 P14635 2/20 0.51
CDK2 P24941 2/20 0.51
CDK7 P50613 2/20 0.51
CDK9 P50750 2/20 0.51
CCNH P51946 2/20 0.51
CDK5 Q00535 1/20 0.51
EGFR P00533 3/20 0.49
PLK4 O00444 2/20 0.48
CDC7 O00311 1/20 0.48
CA1 P00915 5/20 0.48
CA2 P00918 5/20 0.48
CA9 Q16790 5/20 0.48
HTR2C P28335 1/20 0.47
MAPK1 P28482 1/20 0.46
CA12 O43570 4/20 0.45
PAK4 O96013 1/20 0.44

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
SCHEMBL13896206 0.91 CCNT1 (0.58) KDRCDK1CCNT1CCNB1CDK2
SCHEMBL13896209 0.87 MKNK1 (0.67) KDRMKNK1CDK2EGFRPLK4
SCHEMBL13896208 0.86 PLK4 (0.57) KDRCDK1CCNT1CCNB1CDK2
SCHEMBL4266513 0.86 PLK4 (0.57) KDRCDK1CCNT1CCNB1CDK2
SCHEMBL4797977 0.84 KDR (0.58) KDRMKNK1CDK1CCNT1CCNB1
SCHEMBL4259513 0.83 EGFR (0.49) KDRMKNK1CDK2EGFRPLK4
SCHEMBL13896563 0.83 MKNK1 (0.58) KDRMKNK1CDK7CDK9CDK5
SCHEMBL13896212 0.82 TNNI3K (0.55) KDRMKNK1CDK1CCNT1CCNB1
SCHEMBL3283879 0.81 KDR (0.50) KDRCDK1CCNT1CCNB1CDK2
SCHEMBL10242647 0.81 SYK (0.67) KDRCDK1CCNT1CCNB1CDK2

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
US-8314234-B2 Bicyclic pyrimidine kinase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2012-11-20 US claimed
US-20090076037-A1 BICYCLIC PYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2009-03-19 US claimed
WO-2008039359-A2 BICYCLIC PYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-04-03 WO claimed
US-8314234-B2 Bicyclic pyrimidine kinase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2012-11-20 US disclosed
US-8314234-B2 Bicyclic pyrimidine kinase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2012-11-20 US disclosed
US-8314234-B2 Bicyclic pyrimidine kinase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2012-11-20 US disclosed
US-20090076037-A1 BICYCLIC PYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2009-03-19 US disclosed
US-20090076037-A1 BICYCLIC PYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2009-03-19 US disclosed
US-20090076037-A1 BICYCLIC PYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2009-03-19 US disclosed
WO-2008039359-A2 BICYCLIC PYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-04-03 WO disclosed
WO-2008039359-A2 BICYCLIC PYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-04-03 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-20090076037-A1 BICYCLIC PYRIMIDINE KINASE INHIBITORS DCK, CDK2, DTYMK KDR 1646/4885MKNK1 135/4885CDK1 8/4885

“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.