SCHEMBL23508159

SCHEMBL23508159

Cc1ccnc2[nH]c(CNc3nc(N4CCN(C)CC4)nc4c(C(C)C)cnn34)nc12

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CDK9 P50750 12/20 0.42
CDK2 P24941 11/20 0.42
CSNK1D P48730 8/20 0.40
CSNK1E P49674 8/20 0.40
CCNE1 P24864 1/20 0.39

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
SCHEMBL30013789 1.00 CDK9 (0.42) CDK9CDK2CSNK1DCSNK1ECCNE1
SCHEMBL23497822 0.91 CDK2 (0.40) CDK9CDK2CSNK1DCSNK1E
SCHEMBL30013666 0.91 CDK2 (0.40) CDK9CDK2CSNK1DCSNK1E
SCHEMBL30013054 0.81 CDK2 (0.39) CDK9CDK2CCNE1
SCHEMBL23508048 0.81 CDK2 (0.39) CDK9CDK2CCNE1
SCHEMBL23508209 0.80 CDK2 (0.38) CDK9CDK2CCNE1
SCHEMBL30012848 0.80 CSNK1D (0.52) CDK9CDK2CSNK1DCSNK1ECCNE1
SCHEMBL23497873 0.80 CSNK1D (0.52) CDK9CDK2CSNK1DCSNK1ECCNE1
SCHEMBL23508287 0.79 CDK2 (0.49) CDK9CDK2CSNK1DCSNK1ECCNE1
SCHEMBL23508266 0.79 CSNK1E (0.40) CDK9CSNK1DCSNK1E

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-20230117034-A1 PYRAZOLOTRIAZINES BAYER AKTIENGESELLSCHAFT (DE) 2023-04-20 US disclosed
WO-2021116178-A1 PYRAZOLOTRIAZINES BAYER AKTIENGESELLSCHAFT (DE) 2021-06-17 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-20230117034-A1 PYRAZOLOTRIAZINES BRCA1, TPX2, CCND2 CDK9 889/4885CDK2 43/4885CSNK1D 963/4885

“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.