SCHEMBL14613388

SCHEMBL14613388

CCOc1ccccc1CN1CCCC(c2cc(NCc3cccnc3)n3ncc(Br)c3n2)C1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 15/20 0.64
▸ CDK2 P24941 6/20 0.49
▸ CCNE1 P24864 3/20 0.49

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
SCHEMBL13122146 0.93 GSK3B (0.66) GSK3BCDK2CCNE1
SCHEMBL13122133 0.88 GSK3B (0.69) GSK3BCDK2CCNE1
SCHEMBL13122129 0.88 GSK3B (0.69) GSK3BCDK2CCNE1
SCHEMBL13122151 0.88 GSK3B (0.69) GSK3BCDK2CCNE1
SCHEMBL14545990 0.88 GSK3B (0.69) GSK3BCDK2CCNE1
SCHEMBL13122170 0.87 GSK3B (0.66) GSK3BCDK2CCNE1
SCHEMBL13122168 0.87 GSK3B (0.68) GSK3BCDK2CCNE1
SCHEMBL12954482 0.85 GSK3B (0.66) GSK3BCDK2CCNE1
SCHEMBL12954360 0.85 GSK3B (0.66) GSK3BCDK2CCNE1
SCHEMBL13122185 0.85 GSK3B (0.67) GSK3BCDK2CCNE1

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-20070037824-A1 Enzyme inhibitors from pyrazolo[1,5a]pyrimidine as enzyme inhibitors SCHERING CORPORATION 2007-02-15 — — 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-20070037824-A1 Enzyme inhibitors from pyrazolo[1,5a]pyrimidine as enzyme inhibitors CDK2, CDK5, CDKN1A GSK3B 937/4885CDK2 1/4885CCNE1 40/4885

“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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