SCHEMBL13721952

SCHEMBL13721952

Cn1ccnc1-c1cccc(C(=O)CNc2nc(-c3ccncn3)cc(=O)n2C)c1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 14/20 0.63
▸ RIPK2 O43353 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
SCHEMBL13721948 0.90 GSK3B (0.58) GSK3B
SCHEMBL13910060 0.90 GSK3B (0.78) GSK3BRIPK2
SCHEMBL13722392 0.88 GSK3B (0.68) GSK3B
SCHEMBL13721667 0.88 GSK3B (0.67) GSK3B
SCHEMBL4029898 0.88 GSK3B (0.77) GSK3B
SCHEMBL13721911 0.88 GSK3B (0.63) GSK3B
SCHEMBL13722107 0.86 GSK3B (0.60) GSK3B
SCHEMBL13721916 0.84 GSK3B (0.58) GSK3B
SCHEMBL4031690 0.84 GSK3B (0.75) GSK3B
SCHEMBL13722124 0.84 GSK3B (0.57) GSK3B

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-7572793-B2 3-Substituted-4-pyrimidone derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-08-11 — — US disclosed
US-7572793-B2 3-Substituted-4-pyrimidone derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-08-11 — — US disclosed
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