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SCHEMBL5224205

SCHEMBL5224205

CN1CCN(S(=O)(=O)c2ccc(-c3cnc(N)c(C(=O)NCCN4CCNC4=O)n3)cc2)CC1

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 20/20 0.74
▸ CCNE2 O96020 16/20 0.74
▸ CCNE1 P24864 16/20 0.74
▸ CDK2 P24941 16/20 0.74
▸ GSK3A P49840 1/20 0.62

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
Hydrochloric Acid SCHEMBL3277935 0.99 GSK3B (0.73) GSK3BCCNE2CCNE1CDK2GSK3A
SCHEMBL5223562 0.86 GSK3B (0.82) GSK3BCCNE2CCNE1CDK2GSK3A
SCHEMBL5222268 0.86 GSK3B (0.82) GSK3BCCNE2CCNE1CDK2GSK3A
Hydrochloric Acid SCHEMBL5222265 0.85 GSK3B (0.57) GSK3BCCNE2CCNE1CDK2GSK3A
SCHEMBL5220043 0.85 GSK3B (0.78) GSK3BCCNE2CCNE1CDK2GSK3A
SCHEMBL5224389 0.85 GSK3B (0.80) GSK3BCCNE2CCNE1CDK2GSK3A
Hydrochloric Acid SCHEMBL3273594 0.85 GSK3B (0.80) GSK3BCCNE2CCNE1CDK2GSK3A
Hydrochloric Acid SCHEMBL3273865 0.85 GSK3B (0.80) GSK3BCCNE2CCNE1CDK2GSK3A
Hydrochloric Acid SCHEMBL3273957 0.85 GSK3B (0.77) GSK3BCCNE2CCNE1CDK2GSK3A
Hydrochloric Acid SCHEMBL5879285 0.85 GSK3B (0.53) GSK3BCCNE2CCNE1CDK2GSK3A

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
EP-1575942-B1 COMPOUNDS HAVING SELECTIVE INHIBITING EFECT AT GSK3 ASTRAZENECA AB (SE) 2007-05-02 — — EP claimed