SCHEMBL8662952

SCHEMBL8662952

COC(=O)c1ccc(N(C)C(C)=O)cc1S(N)(=O)=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.54
CA1 P00915 3/20 0.54
CA9 Q16790 3/20 0.54
CA5A P35218 1/20 0.54
GAA P10253 2/20 0.44
CA12 O43570 2/20 0.40
CA7 P43166 2/20 0.40
CA14 Q9ULX7 2/20 0.40
PDK2 Q15119 1/20 0.40
PDK4 Q16654 1/20 0.40
CDK1 P06493 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 2/20 0.38
HSD17B10 Q99714 2/20 0.38
GLA P06280 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38

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
SCHEMBL8663517 0.89 CA2 (0.54) CA2CA1CA9CA5AGAA
SCHEMBL9196485 0.86 CA2 (0.54) CA2CA1CA9CA5AGAA
SCHEMBL9198890 0.81 CA2 (0.54) CA2CA1CA9CA5AGAA
SCHEMBL8803262 0.78 CA2 (0.46) CA2CA1CA9CA5AGAA
SCHEMBL7465896 0.78 CA2 (0.54) CA2CA1CA9CA5AGAA
SCHEMBL8030650 0.77 GAA (0.67) CA2CA1CA9CA5AGAA
SCHEMBL22010624 0.76 CA2 (0.63) CA2CA1CA9CA5AGAA
SCHEMBL11372105 0.76 CA1 (0.63) CA2CA1CA9CA5AGAA
SCHEMBL21962935 0.75 CA2 (0.54) CA2CA1CA9CA5AGAA
SCHEMBL21962924 0.75 CA2 (0.61) CA2CA1CA9CA5AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5723409-A Intermediates for the preparation of phenylsulfonylurea herbicides and plant growth regulators HOECHST SCHERING AGREVO GMBH (DE) 1998-03-03 US disclosed
EP-0666852-B1 NEW PHENYLSULPHONYL UREAS, THEIR PREPARATION AND THEIR USE AS HERBICIDES AND PLANT-GROWTH REGULATORS HOECHST SCHERING AGREVO GMBH (DE) 1997-01-22 EP disclosed
US-5449812-A Substituted benzenesulfonamide derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1995-09-12 US disclosed
EP-0666852-A1 NEW PHENYLSULPHONYL UREAS, THEIR PREPARATION AND THEIR USE AS HERBICIDES AND PLANT-GROWTH REGULATORS. HOECHST SCHERING AGREVO GMBH (DE) 1995-08-16 EP disclosed
WO-1994010154-A1 NEW PHENYLSULPHONYL UREAS, THEIR PREPARATION AND THEIR USE AS HERBICIDES AND PLANT-GROWTH REGULATORS HOECHST SCHERING AGREVO GMBH (DE) 1994-05-11 WO disclosed