SCHEMBL6942887

SCHEMBL6942887

COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2ccccc2N)n1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.60
CDK1 P06493 1/20 0.53
MAPT P10636 3/20 0.49
TP53 P04637 1/20 0.49
GLA P06280 1/20 0.49
CYP1A2 P05177 1/20 0.47
HDAC1 Q13547 1/20 0.46
KMT2A Q03164 1/20 0.44
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 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
SCHEMBL10733365 0.93 GAA (0.53) GAACDK1MAPTTP53GLA
Hydrochloric Acid SCHEMBL11113105 0.92 GAA (0.52) GAACDK1MAPTTP53GLA
SCHEMBL11454190 0.92 GAA (0.55) GAACDK1MAPTTP53GLA
SCHEMBL10616134 0.91 GAA (0.67) GAACDK1MAPTTP53GLA
SCHEMBL10616100 0.88 GAA (0.60) GAACDK1MAPTTP53GLA
SCHEMBL10884559 0.86 GAA (0.61) GAACDK1MAPTTP53GLA
Trolamine SCHEMBL11102369 0.86 SMN1; SMN2 (0.47) GAACDK1MAPTTP53GLA
SCHEMBL10339438 0.85 GAA (0.60) GAACDK1MAPTTP53GLA
SCHEMBL1405765 0.84 GAA (0.59) GAACDK1MAPTTP53GLA
SCHEMBL10469643 0.84 GAA (0.59) 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4369058-A PLANT GROWTH REGULATORS, HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-01-18 US claimed
EP-0912093-B1 (HETERO)ARYL SULPHONYL UREAS WITH AN IMINOFUNCTION, THE PREPARATION AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE GMBH (DE) 2003-08-06 EP disclosed
US-6410482-B1 CONTROLLING WEEDS, GRASSES; COMPOUND CONTAINING PYRIMIDINE RING HOECHST SCHERING AGREVO GMBH (DE) 2002-06-25 US disclosed
EP-0863706-B1 METHOD OF CONTROLLING UNDESIRED PLANT GROWTH IN RICE AVENTIS CROPSCIENCE GMBH (DE) 2002-02-20 EP disclosed
US-6017852-A APPLYING CROP PROTECTION AGENTS TO RICE CULTIVATION AREA WHICH CONTAINS MONOCOTYLEDONOUS AND DICOTYLEDONOUS WEEDS HOECHST SCHERING AGREVO GMBH (DE) 2000-01-25 US disclosed
EP-0912093-A1 (HETERO)ARYL SULPHONYL UREAS WITH AN IMINOFUNCTION, THE PREPARATION AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS Hoechst Schering AgrEvo GmbH (DE) 1999-05-06 EP disclosed
WO-1997042822-A1 (HETERO)ARYL SULPHONYL UREAS WITH AN IMINOFUNCTION, THE PREPARATION AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS HOECHST SCHERING AGREVO GMBH (DE) 1997-11-20 WO disclosed
US-4453971-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1984-06-12 US disclosed
US-4369058-A PLANT GROWTH REGULATORS, HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-01-18 US disclosed