SCHEMBL9823679

SCHEMBL9823679

COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2ccccc2-c2nn(C)c(=O)o2)n1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
CDK1 P06493 1/20 0.47
MAPT P10636 3/20 0.41
TP53 P04637 1/20 0.41
GLA P06280 1/20 0.41
EDNRB P24530 1/20 0.38
EDNRA P25101 1/20 0.38
CYP1A2 P05177 1/20 0.38
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL10629684 0.90 GAA (0.38) GAACDK1MAPTKDM4ENPC1
SCHEMBL9823783 0.87 MAPT (0.40) GAACDK1MAPTKDM4ENPC1
SCHEMBL10764375 0.82 GAA (0.51) GAACDK1MAPTTP53GLA
SCHEMBL10616134 0.81 GAA (0.67) GAACDK1MAPTTP53GLA
SCHEMBL10763019 0.80 GAA (0.51) GAACDK1MAPTTP53GLA
SCHEMBL10762380 0.80 GAA (0.51) GAACDK1MAPTTP53GLA
SCHEMBL10911982 0.80 GAA (0.58) GAACDK1MAPTTP53GLA
SCHEMBL9822859 0.80 GAA (0.53) GAACDK1MAPTTP53GLA
SCHEMBL9822976 0.80 GAA (0.50) GAACDK1MAPTTP53GLA
SCHEMBL10363689 0.78 GAA (0.51) GAACDK1MAPTTP53GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0209230-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-02-27 EP claimed
US-4699647-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-10-13 US claimed
EP-0209230-A1 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-01-21 EP claimed
EP-0209230-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-02-27 EP disclosed
US-4764205-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-08-16 US disclosed
US-4699647-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-10-13 US disclosed
EP-0209230-A1 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-01-21 EP disclosed