SCHEMBL3673748

SCHEMBL3673748

COc1cc(OC)nc(NC(=O)NS(=O)(=O)Cc2[nH]nc(Cl)c2C(=O)O)n1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.44
MAPT P10636 2/20 0.40
TP53 P04637 1/20 0.40
GLA P06280 1/20 0.40
CYP1A2 P05177 1/20 0.40
CDK1 P06493 1/20 0.36
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.34
TSHR P16473 1/20 0.34
ADRB2 P07550 1/20 0.33

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
SCHEMBL9755749 0.81 GAA (0.43) GAAMAPTTP53GLACYP1A2
SCHEMBL5790918 0.79 GAA (0.46) GAAMAPTTP53GLACYP1A2
SCHEMBL4465650 0.79 CYP1A2 (0.37) GAAMAPTTP53GLACYP1A2
SCHEMBL5792011 0.76 GAA (0.52) GAAMAPTTP53GLACYP1A2
SCHEMBL8793199 0.74 GAA (0.47) GAAMAPTTP53GLACYP1A2
SCHEMBL10362553 0.73 GAA (0.44) GAAMAPTTP53GLACYP1A2
SCHEMBL10361625 0.73 GAA (0.44) GAAMAPTTP53GLACYP1A2
SCHEMBL20834 0.72 MAPT (0.51) GAAMAPTTP53GLACYP1A2
SCHEMBL5790911 0.72 GAA (0.53) GAAMAPTTP53GLACYP1A2
SCHEMBL29386841 0.72 MAPT (0.51) GAAMAPTTP53GLACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2180789-A2 IMPROVED PROCESSES FOR THE CONTROL OF UNDESIRED VEGETATION Gowan Co. (US) 2010-05-05 EP claimed
WO-2009015064-A2 IMPROVED PROCESSES FOR THE CONTROL OF UNDESIRED VEGETATION GOWAN CO. (US) 2009-01-29 WO claimed
WO-2006009937-A2 NOVEL ESTERS AS USEFUL BROAD SPECTRUM HERBICIDAL COMPOUNDS CORET JOEL MARCEL (US) 2006-01-26 WO claimed
WO-2023217368-A1 USE OF A POLYCARBOXYLATE COPOLYMER AND ALKYL ETHER SULFATE AS COMPATIBILIZER IN TANK MIX COMPOSITION RHODIA BRASIL SA (BR) 2023-11-16 WO disclosed
EP-2180789-A2 IMPROVED PROCESSES FOR THE CONTROL OF UNDESIRED VEGETATION Gowan Co. (US) 2010-05-05 EP disclosed
WO-2009015064-A2 IMPROVED PROCESSES FOR THE CONTROL OF UNDESIRED VEGETATION GOWAN CO. (US) 2009-01-29 WO disclosed
WO-2006009964-A2 NOVEL ESTERS AS USEFUL HERBICIDAL COMPOUNDS CORET JOEL MARCEL (US) 2006-01-26 WO disclosed
WO-2006009937-A2 NOVEL ESTERS AS USEFUL BROAD SPECTRUM HERBICIDAL COMPOUNDS CORET JOEL MARCEL (US) 2006-01-26 WO disclosed