SCHEMBL4451216

SCHEMBL4451216

COc1cc(NC(=O)NS(=O)(=O)N(C)S(C)(=O)=O)nc(OC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 2/20 0.41
CREBBP Q92793 1/20 0.41
GAA P10253 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
TP53 P04637 2/20 0.38
NPC1 O15118 1/20 0.38
NFKB1 P19838 1/20 0.38
RAB9A P51151 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
CDK1 P06493 1/20 0.37
CYP1A2 P05177 1/20 0.35
ADORA3 P0DMS8 2/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 2/20 0.34
GLA P06280 1/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 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
SCHEMBL8347834 0.82 GAA (0.58) GAASMN1; SMN2TP53CDK1CYP1A2
SCHEMBL54922 0.82 GAA (0.58) GAASMN1; SMN2TP53CDK1CYP1A2
SCHEMBL27402181 0.81 FBP1 (0.41) FBP1CREBBPGAASMN1; SMN2TP53
SCHEMBL2320176 0.81 GAA (0.57) GAASMN1; SMN2TP53CDK1CYP1A2
SCHEMBL9621633 0.78 GAA (0.51) GAASMN1; SMN2CDK1CYP1A2LMNA
SCHEMBL27259474 0.77 CDK1 (0.49) FBP1CREBBPGAASMN1; SMN2TP53
SCHEMBL27940030 0.76 GAA (0.49) FBP1CREBBPGAASMN1; SMN2TP53
SCHEMBL27827660 0.75 GAA (0.43) FBP1CREBBPGAASMN1; SMN2TP53
SCHEMBL27966147 0.75 CDK1 (0.48) FBP1CREBBPGAASMN1; SMN2TP53
SCHEMBL27258903 0.74 SMN1; SMN2 (0.45) SMN1; SMN2TP53NPC1NFKB1RAB9A

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100345484-C Application of compound in preparation of chemical hybridization agent for brassica plants NORTHWEST UNIV OF AGRICULTURE (CN) 2007-10-31 CN claimed
CN-1857075-A Application of compound in preparation of chemical hybridization agent for brassica plants NORTHWEST UNIV OF AGRICULTURE (CN) 2006-11-08 CN claimed
CN-101674727-B Pyridonecarboxamides crop protection agents containing the same method for production and use thereof BAYER CROPSCIENCE AG 2014-06-25 CN disclosed
CN-102812960-A Application of monosulfuron ester and sodium salt thereof in preparing plant chemical hybridization agent UNIV NORTHWEST A&F 2012-12-12 CN disclosed
CN-1829442-B Safeners based on aromatic-aliphatic carboxylic acid derivatives BAYER CROPSCIENCE GMBH 2011-05-04 CN disclosed
CN-1829437-B Use of hydroxyaromatic compounds as safeners BAYER CROPSCIENCE GMBH 2011-03-30 CN disclosed
CN-1764374-B Use of aromatic hydroxy compounds as safeners BAYER CROPSCIENCE GMBH 2010-09-22 CN disclosed
CN-101785473-A Safening method BAYER CROPSCIENCE GMBH 2010-07-28 CN disclosed
CN-1949966-B Quinoxalin-2-one derivatives, crop protection agents comprising the same and method for production and use therof BAYER CROPSCIENCE GMBH 2010-05-26 CN disclosed
CN-101677549-A Use of pyridine-2-oxy-3-carboxamides as safeners BAYER CROPSCIENCE AG 2010-03-24 CN disclosed
CN-101674727-A Pyridonecarboxamides crop protection agents containing the same method for production and use thereof BAYER CROPSCIENCE AG 2010-03-17 CN disclosed
CN-1209023-C Liquid formulations BAYER CROPSCIENCE GMBH (DE) 2005-07-06 CN disclosed
CN-1529549-A Agricultural formulations �Ϻ���ͨ��ѧ 2004-09-15 CN disclosed
CN-1481213-A Herbicide agent �Ϻ���ͨ��ѧ 2004-03-10 CN disclosed
US-20030176284-A1 Herbicide combination with acylated aminophenylsulfonylureas BAYER CROPSCIENCE GMBH (DE) 2003-09-18 US disclosed
CN-1430472-A liquid preparation BAYER CROPSCIENCE GMBH (DE) 2003-07-16 CN disclosed
CN-1102142-C Novel N-acyl sulphonamides, novel mixtures of herbicides and antidotes and their use HOECHST SCHERING AGREVO GMBH (DE) 2003-02-26 CN disclosed
CN-1382016-A Anhydrous or low-water suspension concentrates of active substance mixtures for plant protection AVENTIS CROPSCIENCE GMBH (DE) 2002-11-27 CN disclosed
CN-1219840-A Novel N-acyl sulphonamides, novel mixtures of herbicides and antidotes and their use HOECHST SCHERING AGREVO GMBH (DE) 1999-06-16 CN disclosed
CN-1094569-A The herbicidal composition and the herbicidal methods thereof that are used for mountain farming NIHON NOHYAKU CO LTD (JP) 1994-11-09 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030176284-A1 Herbicide combination with acylated aminophenylsulfonylureas AADAC, DDT, DDC FBP1 1044/4885CREBBP 4435/4885GAA 2162/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.