SCHEMBL23629249

SCHEMBL23629249

CNC(=O)c1ccnc2c[nH]nc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.40
SLC40A1 Q9NP59 2/20 0.38
PKN1 Q16512 1/20 0.37
PKN2 Q16513 1/20 0.37
PLK1 P53350 3/20 0.37
AURKA O14965 1/20 0.35
LCK P06239 1/20 0.35
MET P08581 1/20 0.35
KDR P35968 1/20 0.35
TEK Q02763 1/20 0.35
AURKB Q96GD4 1/20 0.35
GAA P10253 1/20 0.34
CCNC P24863 1/20 0.34
CDK8 P49336 1/20 0.34
CREBBP Q92793 1/20 0.34
MAPT P10636 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 1/20 0.33
KDM5A P29375 1/20 0.33
KDM5B Q9UGL1 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
SCHEMBL27009072 0.83 PSMD14 (0.44) SLC40A1PKN1PKN2GAACREBBP
SCHEMBL23629224 0.80 KDM5A (0.45) LMNAKDM5AKDM5BKDM4E
SCHEMBL23629272 0.79 KDM4E (0.44) SLC40A1PKN1PKN2AURKBKDM5A
SCHEMBL23629246 0.78 SLC40A1 (0.38) SLC40A1PKN1PKN2LMNAKDM5A
SCHEMBL25084645 0.72 TGFBR1 (0.44)
SCHEMBL21621362 0.71 PLK1 (0.44) PLK1AURKBGAACREBBPHSD17B10
SCHEMBL162197 0.71 PLK1 (0.39) PKN1PKN2PLK1AURKBGAA
SCHEMBL21621359 0.71 PLK1 (0.39) PKN1PKN2PLK1AURKBGAA
SCHEMBL19905008 0.71 GAA (0.41) PLK1AURKBGAACCNCCDK8
SCHEMBL16572974 0.69 PLK1 (0.38) PTPN11PLK1AURKBGAACCNC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12371430-B2 5-morpholin-4-yl-pyrazolo[4,3-b]pyridine derivatives MERCK PATENT GMBH (DE) 2025-07-29 US claimed
EP-3846904-A1 5-MORPHOLIN-4-YL-PYRAZOLO[4,3-B]PYRIDINE DERIVATIVES Merck Patent GmbH (DE) 2021-07-14 EP 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-12371430-B2 5-morpholin-4-yl-pyrazolo[4,3-b]pyridine derivatives ATR, CDK1, CDKN1A PTPN11 1740/4885SLC40A1 4240/4885PKN1 278/4885

“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.