SCHEMBL14418660

SCHEMBL14418660

Bc1cnn2c(NCc3cccnc3)cc(C3CCCN(Cc4ccc(O)cc4)C3)nc12

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 9/20 0.57
▸ CDK2 P24941 9/20 0.49
▸ CCNE1 P24864 6/20 0.49
▸ CHEK1 O14757 1/20 0.48
▸ DPP4 P27487 1/20 0.42
▸ PDE2A O00408 1/20 0.42

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
SCHEMBL12954057 0.93 GSK3B (0.56) GSK3BCDK2CCNE1CHEK1PDE2A
SCHEMBL14301734 0.93 GSK3B (0.58) GSK3BCDK2CCNE1CHEK1PDE2A
SCHEMBL14613421 0.91 GSK3B (0.55) GSK3BCDK2CHEK1PDE2A
SCHEMBL14301721 0.91 GSK3B (0.55) GSK3BCDK2CCNE1CHEK1PDE2A
SCHEMBL13122135 0.91 GSK3B (0.71) GSK3BCDK2CCNE1
SCHEMBL12954152 0.90 GSK3B (0.55) GSK3BCDK2CCNE1CHEK1PDE2A
SCHEMBL14545902 0.90 GSK3B (0.56) GSK3BCDK2CCNE1CHEK1PDE2A
SCHEMBL14613420 0.89 GSK3B (0.54) GSK3BCDK2CCNE1CHEK1
SCHEMBL14613386 0.89 GSK3B (0.57) GSK3BCDK2CCNE1CHEK1PDE2A
SCHEMBL14613422 0.89 GSK3B (0.52) GSK3BCDK2CCNE1CHEK1PDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070225270-A1 Pyrazolopyrimidines as cyclin dependent kinase inhibitors SCHERING CORPORATION 2007-09-27 — — 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-20070225270-A1 Pyrazolopyrimidines as cyclin dependent kinase inhibitors CDK2, CDKN1A, CDK1 GSK3B 749/4885CDK2 1/4885CCNE1 37/4885

“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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