SCHEMBL8477669

SCHEMBL8477669

CC(NC1=Nc2nccnc2S(=O)(=O)N1)C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.31
PLK1 P53350 2/20 0.31
CDC7 O00311 1/20 0.31
PLK4 O00444 1/20 0.31
DAPK3 O43293 1/20 0.31
ROCK2 O75116 1/20 0.31
CHEK2 O96017 1/20 0.31
PIM1 P11309 1/20 0.31
GSK3A P49840 1/20 0.31
GSK3B P49841 1/20 0.31
PRKX P51817 1/20 0.31
CSNK1G2 P78368 1/20 0.31
PRKCZ Q05513 1/20 0.31
ROCK1 Q13464 1/20 0.31
PKN2 Q16513 1/20 0.31
CDC42BPA Q5VT25 1/20 0.31
PLK3 Q9H4B4 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
MKNK2 Q9HBH9 1/20 0.31
CSNK1G1 Q9HCP0 1/20 0.31

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
SCHEMBL8477864 0.86
SCHEMBL8478464 0.75
SCHEMBL8715824 0.69
SCHEMBL8476298 0.66 ABCC8 (0.39)
SCHEMBL27507636 0.59
SCHEMBL4261297 0.59 CA12 (0.33) CHEK1PLK1CDC7PLK4DAPK3
SCHEMBL8716353 0.57
SCHEMBL2337867 0.56 PLK1 (0.36) CHEK1PLK1CDC7PLK4DAPK3
SCHEMBL27506810 0.55
SCHEMBL13813005 0.49 JAK2 (0.39) CHEK1PLK1CDC7PLK4DAPK3

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
US-5889002-A CENTRAL NERVOUS SYSTEM DISORDERS; CARDIOVASCULAR DISORDERS; RESPIRATORY SYSTEM DISORDERS; GASTROINTESTINAL DISORDERS; ENDOCRINAL DISEASES NOVO NORDISK A/S (DK) 1999-03-30 US disclosed