SCHEMBL2564384

SCHEMBL2564384

O=C1CN=Cc2ncncc21

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
SCHEMBL611310 0.73 CDC25B (0.35) CDC25B
SCHEMBL29476468 0.73 CDC25B (0.35) CDC25B
SCHEMBL25192251 0.69 CDC25B (0.38) CDC25B
SCHEMBL30558038 0.69 CDC25B (0.38) CDC25B
SCHEMBL29930125 0.69 CDC25B (0.35) CDC25B
SCHEMBL25220906 0.68 CDC25B (0.37) CDC25B
SCHEMBL7016696 0.65 CDC25B (0.35) CDC25B
SCHEMBL6217759 0.63 HCAR2 (0.33) CDC25B
SCHEMBL30443999 0.61 CDC25B (0.38) CDC25B
SCHEMBL15386166 0.61 CDC25B (0.38) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011132017-A1 PYRIDO[3,4-D]PYRIMIDINYL ACETAMIDE DERIVATIVES AS TRPA1 MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2011-10-27 WO disclosed