SCHEMBL9202913

SCHEMBL9202913

COC(=O)c1ccc(N(O)C(C)=O)cc1S(=O)(=O)NC(=O)Nc1nc(OC)cc(OC)n1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 2/20 0.55
GAA P10253 1/20 0.51
CYP1A2 P05177 1/20 0.41
MAPT P10636 2/20 0.38
TP53 P04637 1/20 0.38
GLA P06280 1/20 0.38
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL9197645 0.92 CDK1 (0.55) CDK1GAACYP1A2MAPTTP53
SCHEMBL9080269 0.86 CDK1 (0.62) CDK1GAACYP1A2MAPTTP53
SCHEMBL9387441 0.85 GAA (0.52) CDK1GAACYP1A2MAPTTP53
SCHEMBL9199568 0.83 CDK1 (0.39) CDK1GAAKMT2AMEN1
SCHEMBL11385667 0.83 CDK1 (0.57) CDK1GAACYP1A2MAPTTP53
SCHEMBL5847237 0.83 CDK1 (0.54) CDK1GAACYP1A2MAPTTP53
SCHEMBL5847235 0.83 CDK1 (0.54) CDK1GAACYP1A2MAPTTP53
SCHEMBL5846414 0.82 CDK1 (0.62) CDK1GAACYP1A2MAPTTP53
SCHEMBL8507050 0.82 CDK1 (0.56) CDK1GAACYP1A2MAPTTP53
SCHEMBL10395502 0.82 CDK1 (0.56) CDK1GAACYP1A2MAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0660828-A1 HYDROXYL AMINO PHENYL SULPHONYL UREAS, THEIR PREPARATION AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS Hoechst Schering AgrEvo GmbH (DE) 1995-07-05 EP disclosed
WO-1994006778-A1 HYDROXYL AMINO PHENYL SULPHONYL UREAS, THEIR PREPARATION AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS HOECHST SCHERING AGREVO GMBH (DE) 1994-03-31 WO disclosed