SCHEMBL10469643

SCHEMBL10469643

COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2ccccc2C(=O)O)n1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.59
CDK1 P06493 1/20 0.54
MAPT P10636 3/20 0.51
TP53 P04637 1/20 0.51
GLA P06280 1/20 0.51
KMT2A Q03164 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP8 P22894 1/20 0.46
MMP13 P45452 1/20 0.46
CYP1A2 P05177 1/20 0.46
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43

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
SCHEMBL29371340 0.93 GAA (0.52) GAACDK1MAPTTP53GLA
SCHEMBL119097 0.93 GAA (0.52) GAACDK1MAPTTP53GLA
SCHEMBL10506007 0.93 TSHR (0.53) GAACDK1MAPTTP53GLA
SCHEMBL10364232 0.92 GAA (0.51) GAACDK1MAPTTP53GLA
SCHEMBL1405765 0.91 GAA (0.59) GAACDK1MAPTTP53GLA
SCHEMBL10753795 0.91 GAA (0.59) GAACDK1MAPTTP53GLA
SCHEMBL11246536 0.90 CDK1 (0.51) GAACDK1MAPTTP53GLA
SCHEMBL4887087 0.90 GAA (0.49) GAACDK1MAPTTP53GLA
SCHEMBL10616134 0.90 GAA (0.67) GAACDK1MAPTTP53GLA
SCHEMBL8474474 0.90 GAA (0.56) 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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0030138-B1 HERBICIDAL SULFONAMIDES, AND COMPOSITIONS, PREPARATION AND USE THEREOF E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-06-13 EP claimed
CN-1102858-A New variety of drechslera monoceras, weed control compositions containing the same as an effective ingredient and weed control methods using the same MITSUI TOATSU CHEMICALS (JP) 1995-05-24 CN disclosed
US-4897108-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-01-30 US disclosed
US-4881968-A ORTHO-CARBOXYLATE ARYL SUBSTITUTED E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-11-21 US disclosed
US-4769060-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-09-06 US disclosed
US-4661147-A PLANT GROWTH REGULATORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-04-28 US disclosed
US-4640704-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-02-03 US disclosed
US-4582525-A PRE-AND POST- EMERGENCE HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-04-15 US disclosed
EP-0165003-A2 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-12-18 EP disclosed
EP-0044210-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-04-03 EP disclosed
US-4492599-A Herbicidal s-triazines E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-01-08 US disclosed
EP-0044209-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-10-31 EP disclosed
US-4474601-A HETEROCYCLICAMINOCARBONYL DERIVATIVES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1984-10-02 US disclosed
EP-0030139-B1 HERBICIDAL UREAS AND ISOUREAS, PREPARATION AND USE THEREOF, AND COMPOSITIONS CONTAINING THEM E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-05-23 EP disclosed
US-4370480-A Herbicidal ureas and isoureas E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-01-25 US disclosed
US-4368069-A PRE- AND POSTEMERGENCE HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-01-11 US disclosed
US-4332611-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-06-01 US disclosed
EP-0044210-A1 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1982-01-20 EP disclosed
EP-0044209-A1 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1982-01-20 EP disclosed
EP-0030139-A2 Herbicidal ureas and isoureas, preparation and use thereof, and compositions containing them E.I. DU PONT DE NEMOURS AND COMPANY (US) 1981-06-10 EP disclosed