SCHEMBL6071598

SCHEMBL6071598

COc1cccc(-n2ncc3c(NN=Cc4ccc(N(C)C)nc4)ncnc32)n1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 20/20 0.73
GSK3A P49840 4/20 0.53

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
SCHEMBL8344612 1.00 GSK3B (0.73) GSK3BGSK3A
SCHEMBL8345510 0.88 GSK3B (0.75) GSK3BGSK3A
SCHEMBL6071677 0.88 GSK3B (0.75) GSK3BGSK3A
SCHEMBL8343916 0.85 GSK3B (0.83) GSK3BGSK3A
SCHEMBL8344625 0.84 GSK3B (1.00) GSK3BGSK3A
SCHEMBL6071428 0.82 GSK3B (0.76) GSK3BGSK3A
SCHEMBL6071408 0.82 GSK3B (0.76) GSK3BGSK3A
SCHEMBL6071672 0.81 GSK3B (0.76) GSK3BGSK3A
SCHEMBL6071679 0.81 GSK3B (0.76) GSK3BGSK3A
SCHEMBL6071214 0.81 GSK3B (0.76) GSK3BGSK3A

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-20060167020-A1 Pyrazolopyrimidines as kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2006-07-27 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-20060167020-A1 Pyrazolopyrimidines as kinase inhibitors MAP3K12, MAP3K5, MAP3K2 GSK3B 591/4885GSK3A 662/4885

“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.