SCHEMBL8343264

SCHEMBL8343264

COc1cccc(-n2ncc3c(N/N=C/c4ccc(C(=O)NCCCN(C)C)cc4)ncnc32)n1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 19/20 0.70
GSK3A P49840 6/20 0.70

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
SCHEMBL6071214 0.96 GSK3B (0.76) GSK3BGSK3A
SCHEMBL6071715 0.88 GSK3B (0.61) GSK3BGSK3A
SCHEMBL6071712 0.88 GSK3B (0.61) GSK3BGSK3A
SCHEMBL6071877 0.88 GSK3B (0.77) GSK3BGSK3A
SCHEMBL6071872 0.88 GSK3B (0.77) GSK3BGSK3A
SCHEMBL8344774 0.87 GSK3B (0.64) GSK3BGSK3A
SCHEMBL8343489 0.87 GSK3B (0.64) GSK3BGSK3A
SCHEMBL6071428 0.84 GSK3B (0.76) GSK3BGSK3A
SCHEMBL6071408 0.84 GSK3B (0.76) GSK3BGSK3A
Hydrochloric Acid SCHEMBL6071059 0.83 GSK3B (0.80) 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
WO-2004009597-A2 PYRAZOLOPYRIMIDINES AS PROTEIN KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-01-29 WO disclosed