SCHEMBL15565491

SCHEMBL15565491

CSc1ncc2c(=O)[nH]cc(-c3c[nH]c4cc(C#N)ccc34)c2n1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CCNK O75909 11/20 0.43
▸ CDK12 Q9NYV4 11/20 0.43
▸ CDK2 P24941 6/20 0.43
▸ CCNT1 O60563 5/20 0.43
▸ CCNE1 P24864 5/20 0.43
▸ CDK9 P50750 5/20 0.43
▸ CDK7 P50613 8/20 0.36
▸ CCNH P51946 8/20 0.36
▸ MNAT1 P51948 7/20 0.36
▸ MAP3K14 Q99558 1/20 0.36
▸ IDO1 P14902 1/20 0.36
▸ PDE9A O76083 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.34
▸ GSK3B P49841 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33

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
SCHEMBL15598335 0.85 CCNK (0.43) CCNKCDK12CDK2CCNT1CCNE1
SCHEMBL15564943 0.84 CCNK (0.42) CCNKCDK12CDK2CCNT1CCNE1
SCHEMBL24311837 0.70 MAP3K14 (0.47) CCNKCDK12CDK2CCNT1CCNE1
SCHEMBL20654437 0.69 MEN1 (0.41) PDE9AKDM4E
SCHEMBL30955673 0.69 MEN1 (0.41) PDE9AKDM4E
SCHEMBL25599273 0.69 CCNK (0.60) CCNKCDK12CDK2CCNT1CCNE1
SCHEMBL25029293 0.68 MAP3K14 (0.48) CCNKCDK12CDK2CCNT1CCNE1
SCHEMBL29364271 0.68 MAP3K14 (0.48) CCNKCDK12CDK2CCNT1CCNE1
SCHEMBL24339631 0.68 MEN1 (0.40) PDE9AGSK3B
SCHEMBL24340067 0.68 MEN1 (0.42) CDK9CDK7PDE9AKDM4EGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9725462-B2 Pyridopyrimidine derivatives as protein kinase inhibitors MERCK PATENT GMBH (DE) 2017-08-08 — — US disclosed
US-9725462-B2 Pyridopyrimidine derivatives as protein kinase inhibitors MERCK PATENT GMBH (DE) 2017-08-08 — — US disclosed
EP-2882746-B1 PYRIDOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2016-12-07 — — EP disclosed
EP-2882746-B1 PYRIDOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2016-12-07 — — EP disclosed
US-20150218186-A1 PYRIDOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2015-08-06 — — US disclosed
US-20150218186-A1 PYRIDOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2015-08-06 — — US disclosed
EP-2882746-A1 PYRIDOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS Merck Patent GmbH (DE) 2015-06-17 — — EP disclosed
WO-2014023385-A1 PYRIDOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2014-02-13 — — WO disclosed
WO-2014023385-A1 PYRIDOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2014-02-13 — — 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-20150218186-A1 PYRIDOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS SYK, LYN, IRAK1 CCNK 345/4885CDK12 315/4885CDK2 39/4885

“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.

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