SCHEMBL7010625

SCHEMBL7010625

O=C1CN=Nc2cncnc21

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 1/20 0.35

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
SCHEMBL1180 0.71 CDC25B (0.39) CDC25B
SCHEMBL29965655 0.71 CDC25B (0.39) CDC25B
SCHEMBL16180251 0.71 CDC25B (0.39) CDC25B
SCHEMBL7016696 0.69 CDC25B (0.35) CDC25B
SCHEMBL7737681 0.68 CDC25B (0.41) CDC25B
Methyl Alcohol SCHEMBL18284553 0.67 CDC25B (0.36) CDC25B
SCHEMBL29930125 0.65 CDC25B (0.35) CDC25B
SCHEMBL4574418 0.64 CDC25B (0.38) CDC25B
SCHEMBL4020923 0.63 CDC25B (0.36) CDC25B
SCHEMBL4588164 0.63 CDC25B (0.31) CDC25B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0733633-A1 Heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-09-25 EP claimed
EP-0733633-B1 Heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-05-28 EP disclosed
EP-0733633-A1 Heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-09-25 EP disclosed