SCHEMBL15565644

SCHEMBL15565644

Cc1ncc(-c2c[nH]c3cc(C#N)ccc23)c2nc(N[C@@H]3CCCC[C@@H]3N)ncc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNK O75909 12/20 0.48
▸ CDK12 Q9NYV4 12/20 0.48
▸ CDK2 P24941 6/20 0.48
▸ CDK9 P50750 6/20 0.48
▸ CCNT1 O60563 5/20 0.48
▸ CCNE1 P24864 5/20 0.48
▸ CDK7 P50613 12/20 0.46
▸ CCNH P51946 11/20 0.46
▸ MNAT1 P51948 10/20 0.46
▸ SYK P43405 2/20 0.42
▸ CDK1 P06493 2/20 0.40
▸ CDC7 O00311 1/20 0.40
▸ PLK4 O00444 1/20 0.40
▸ CHEK1 O14757 1/20 0.40
▸ DCLK1 O15075 1/20 0.40
▸ MAPK13 O15264 1/20 0.40
▸ PDPK1 O15530 1/20 0.40
▸ DAPK3 O43293 1/20 0.40
▸ DYRK3 O43781 1/20 0.40
▸ JAK2 O60674 1/20 0.40

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
SCHEMBL15565642 1.00 CCNK (0.48) CCNKCDK12CDK2CDK9CCNT1
SCHEMBL15598388 1.00 CCNK (0.48) CCNKCDK12CDK2CDK9CCNT1
SCHEMBL24311839 0.88 CCNK (0.48) CCNKCDK12CDK2CDK9CCNT1
SCHEMBL15566082 0.88 CCNK (0.48) CCNKCDK12CDK2CDK9CCNT1
SCHEMBL15568469 0.86 CCNK (0.49) CCNKCDK12CDK2CDK9CCNT1
SCHEMBL16978989 0.86 CCNK (0.49) CCNKCDK12CDK2CDK9CCNT1
SCHEMBL15568467 0.86 CCNK (0.49) CCNKCDK12CDK2CDK9CCNT1
SCHEMBL15566724 0.85 CCNK (0.40) CCNKCDK12CDK2CDK9CCNT1
SCHEMBL15566723 0.85 CCNK (0.40) CCNKCDK12CDK2CDK9CCNT1
SCHEMBL24311767 0.80 CDK7 (0.47) CCNKCDK12CDK2CDK9CCNT1

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 8 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 claimed
EP-2882746-B1 PYRIDOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2016-12-07 — — EP claimed
US-20150218186-A1 PYRIDOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2015-08-06 — — US claimed
EP-2882746-A1 PYRIDOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS Merck Patent GmbH (DE) 2015-06-17 — — EP claimed
WO-2014023385-A1 PYRIDOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2014-02-13 — — WO claimed
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
US-20150218186-A1 PYRIDOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2015-08-06 — — US 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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