Ethofumesate

Ethofumesate

SCHEMBL8536662

CCOC1Oc2ccc(OS(C)(=O)=O)cc2C1(C)C.CCOC1Oc2ccc(OS(C)(=O)=O)cc2C1(C)C

nearest known ligand 0.37

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.37
CA5A P35218 2/20 0.37
KDM4E B2RXH2 4/20 0.37
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
HPGD P15428 1/20 0.36
ALDH1A1 P00352 4/20 0.36
ALDH1A2 O94788 1/20 0.34
ALDH1B1 P30837 1/20 0.34
ALDH1A3 P47895 1/20 0.34
GAA P10253 2/20 0.34
ALPL P05186 1/20 0.34
ALPI P09923 1/20 0.34
NQO1 P15559 1/20 0.33
POR P16435 1/20 0.33
ACHE P22303 8/20 0.33
BCHE P06276 7/20 0.33
MEN1 O00255 1/20 0.32
PSMD14 O00487 1/20 0.32

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
Ethofumesate SCHEMBL29355311 1.00 CA2 (0.37) CA2CA5AKDM4EMAPTLMNA
Ethofumesate SCHEMBL5475440 1.00 CA2 (0.37) CA2CA5AKDM4EMAPTLMNA
Ethofumesate SCHEMBL55264 1.00 CA2 (0.37) CA2CA5AKDM4EMAPTLMNA
Ethofumesate SCHEMBL27295007 0.96 ALDH1A1 (0.36) CA2CA5AKDM4EMAPTLMNA
Ethofumesate SCHEMBL20267522 0.94 CA2 (0.34) CA2CA5AKDM4EMAPTLMNA
Ethofumesate SCHEMBL7170449 0.94 CA2 (0.34) CA2CA5AKDM4EMAPTLMNA
Ethofumesate SCHEMBL28190725 0.93 PPARA (0.35) CA2CA5AKDM4EMAPTLMNA
SCHEMBL11625186 0.90 KDM4E (0.36) CA2CA5AKDM4EMAPTLMNA
SCHEMBL11254527 0.90 ALPI (0.38) CA2ALPLALPINQO1POR
SCHEMBL11419854 0.89 CA2 (0.34) CA2ACHEBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0574418-B1 ARYL SULPHONYL UREA COMPOUNDS, A METHOD OF PREPARING THEM, AND THEIR USE AS HERBICIDES AND GROWTH REGULATORS HOECHST SCHERING AGREVO GMBH (DE) 1998-11-11 EP disclosed
US-5688745-A Arylsulfonylureas and their use as herbicides and growth regulators HOECHST AKTIENGESELLSCHAFT (DE) 1997-11-18 US disclosed
US-5463081-A Chemical intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed
WO-1992013845-A1 ARYL SULPHONYL UREA COMPOUNDS, A METHOD OF PREPARING THEM, AND THEIR USE AS HERBICIDES AND GROWTH REGULATORS HOECHST AKTIENGESELLSCHAFT (DE) 1992-08-20 WO disclosed
US-5013353-A Herbicidal method using diflufenican MAY & BAKER LIMITED (GB) 1991-05-07 US disclosed