SCHEMBL11684189

SCHEMBL11684189

CS(=O)(=O)Nc1ccc2nsc(N)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD3 O94806 3/20 0.47
ROCK1 Q13464 2/20 0.47
CLK4 Q9HAZ1 2/20 0.47
LIMK1 P53667 2/20 0.47
CHEK1 O14757 1/20 0.47
CDK8 P49336 1/20 0.47
DYRK1B Q9Y463 1/20 0.47
MET P08581 11/20 0.45
CDC7 O00311 2/20 0.44
PLK4 O00444 2/20 0.44
DYRK3 O43781 2/20 0.44
MAP4K4 O95819 2/20 0.44
CDK2 P24941 2/20 0.44
CSNK2A1 P68400 2/20 0.44
CAMK2B Q13554 2/20 0.44
CAMK2G Q13555 2/20 0.44
CAMK2D Q13557 2/20 0.44
DYRK1A Q13627 2/20 0.44
BRSK1 Q8TDC3 2/20 0.44
AURKB Q96GD4 2/20 0.44

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
SCHEMBL9722749 0.76 G6PD (0.41) KDRPIK3CB
SCHEMBL14508922 0.76 MET (0.39) PRKD3ROCK1CLK4LIMK1CHEK1
SCHEMBL11698042 0.73 MAPK10 (0.36) MET
SCHEMBL10967457 0.73 LIMK1 (0.52) PRKD3ROCK1CLK4LIMK1CHEK1
SCHEMBL20748370 0.71 CA1 (0.42) CA12CA1CA2CA9
SCHEMBL8063590 0.70 ALDH1A1 (0.46) CA12CA1CA2
SCHEMBL21709938 0.70 LMNA (0.67) CA1CA2PIK3CB
SCHEMBL9722741 0.70 MAPT (0.43)
SCHEMBL1530134 0.68 CA12 (0.52) PRKD3ROCK1CLK4LIMK1CHEK1
SCHEMBL11207644 0.67 CDC7 (0.63) PRKD3METCDC7PLK4DYRK3

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-4001203-A Heavy metal complexes of azo dyestuffs containing a heterocyclic diazo component and the residue of 5-halogeno-2,3-dihydrozypyridine as coupling component CIBA-GEIGY AG (CH) 1977-01-04 US disclosed