SCHEMBL9435557

SCHEMBL9435557

CCn1nnnc1-c1ccccc1S(=O)(=O)NC(=O)Nc1nc(Cl)cc(OC)n1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
CDK1 P06493 1/20 0.41
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TP53 P04637 1/20 0.38
HTT P42858 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
SCHEMBL9756681 0.95 GAA (0.48) GAAALDH1A1KDM4ENPC1CDK1
SCHEMBL9822721 0.89 GAA (0.45) GAAALDH1A1KDM4ENPC1CDK1
SCHEMBL9822976 0.83 GAA (0.50) GAAALDH1A1KDM4ENPC1CDK1
SCHEMBL9822877 0.80 GAA (0.45) GAAALDH1A1CDK1SMN1; SMN2TP53
SCHEMBL8114194 0.80 GAA (0.47) GAAALDH1A1KDM4ENPC1CDK1
SCHEMBL10388677 0.78 GAA (0.53) GAAALDH1A1KDM4ENPC1CDK1
Chlorimuron Ethyl SCHEMBL9141286 0.77 ALDH1A1 (0.48) GAAALDH1A1KDM4ENPC1CDK1
Chlorimuron Ethyl SCHEMBL20214247 0.77 ALDH1A1 (0.48) GAAALDH1A1KDM4ENPC1CDK1
Chlorimuron Ethyl SCHEMBL29370868 0.77 ALDH1A1 (0.48) GAAALDH1A1KDM4ENPC1CDK1
Chlorimuron Ethyl SCHEMBL54938 0.77 ALDH1A1 (0.48) GAAALDH1A1KDM4ENPC1CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0204513-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-07-17 EP claimed
US-4746353-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-05-24 US claimed
EP-0204513-A2 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1986-12-10 EP claimed
JP-6025228-A None JP disclosed
JP-H0625228-A HERBICIDAL SULFONAMIDES E I DU PONT DE NEMOURS & CO 1994-02-01 JP disclosed
EP-0204513-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-07-17 EP disclosed
US-5017214-A Herbicidal sulfonamides LEVITT GEORGE (US) 1991-05-21 US disclosed
US-4913726-A PLANT GROWTH REGULATORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-04-03 US disclosed
US-4786311-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-11-22 US disclosed
US-4746353-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-05-24 US disclosed
EP-0204513-A2 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1986-12-10 EP disclosed