SCHEMBL2467011

SCHEMBL2467011

CS(=O)(=O)c1cc(Cl)ccc1-c1noc(C2CC2)c1C(=O)c1c(-c2ccc(Cl)cc2S(C)(=O)=O)noc1C1CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 2/20 0.47
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41
POLB P06746 1/20 0.36
NR1H4 Q96RI1 5/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA4 P22748 2/20 0.35
CA7 P43166 2/20 0.35
IDH1 O75874 2/20 0.35
STAT3 P40763 1/20 0.34
RET P07949 1/20 0.34
MAPT P10636 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 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
SCHEMBL29397419 1.00 GPBAR1 (0.47) GPBAR1PPARGPPARDPPARAPOLB
SCHEMBL28600495 0.94 GPBAR1 (0.44) GPBAR1PPARGPPARDPPARAPOLB
SCHEMBL27574042 0.92 GPBAR1 (0.46) GPBAR1PPARGPPARDPPARAPOLB
SCHEMBL2467014 0.83 GPBAR1 (0.36) GPBAR1PPARGPPARDPPARANR1H4
SCHEMBL8762913 0.77 SMURF2 (0.38) GPBAR1PPARGPPARDPPARANR1H4
SCHEMBL6596749 0.76 GPBAR1 (0.36) GPBAR1PPARGPPARDPPARANR1H4
SCHEMBL8493346 0.75 NR1H4 (0.38) GPBAR1PPARGPPARDPPARAPOLB
SCHEMBL6607062 0.74 GPBAR1 (0.34) GPBAR1STAT3RAB9A
SCHEMBL22772592 0.74 PPARG (0.54) GPBAR1PPARGPPARDPPARAPOLB
SCHEMBL28143152 0.73 STAT3 (0.42) STAT3RETRAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8772199-B2 Herbicidal compositions for tolerant or resistant maize crops BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-07-08 US disclosed
US-8216975-B2 Method of labelling soya varieties Syngenta Crop Protection Inc (US) 2012-07-10 US disclosed
US-20110224077-A1 Herbicidal Compositions for Tolerant or Resistant Maize Crops BAYER CORPSCIENCE AG (DE) 2011-09-15 US disclosed
US-20100099562-A1 HERBICIDE COMBINATION BAYER CROPSCIENCE AG (DE) 2010-04-22 US disclosed
CN-101584333-A Herbicides with acylated aminophenylsulfonyl urea BAYER CROPSCIENCE GMBH (DE) 2009-11-25 CN disclosed
CN-100518511-C Herbicidal compositions containing acylated aminophenylsulfonylureas AVENTIES CROP SCIENCES GMBH (DE) 2009-07-29 CN disclosed
US-7012040-B2 Glufosinates, glyphosates, imidazolinones, azoles of protoporphyrinogen oxidase inhibitors, cyclohexanediones, heteroaryloxyphenoxypropionic acids, and foliar- and soil-acting hebicides against mono- and di-cotyledonous HOECHST SCHERING AGREVO GMBH (DE) 2006-03-14 US disclosed
US-20050246800-A1 Method of labelling soya varieties SYNGENTA CROP PROTECTION, INC. 2005-11-03 US disclosed
WO-2005013696-A1 METHOD OF CONTROLLING WEEDS IN TRANSGENIC CROPS SYNGENTA PARTICIPATION AG (CH) 2005-02-17 WO disclosed
US-20020094934-A1 Glufosinates, glyphosates, imidazolinones, azoles of protoporphyrinogen oxidase inhibitors, cyclohexanediones, heteroaryloxyphenoxypropionic acids, and foliar- and soil-acting hebicides against mono- and di-cotyledonous BAYER INTELLECTUAL PROPERTY GMBH (DE) 2002-07-18 US 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 (4 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-20100099562-A1 HERBICIDE COMBINATION DDT, MSRB3, PTPN21 GPBAR1 622/4885PPARG 664/4885PPARD 1407/4885
US-20050246800-A1 Method of labelling soya varieties HPD, PEPD, GMDS GPBAR1 2784/4885PPARG 1773/4885PPARD 595/4885
US-20110224077-A1 Herbicidal Compositions for Tolerant or Resistant Maize Crops PPOX, PNPO, DDO GPBAR1 2286/4885PPARG 199/4885PPARD 874/4885
US-20020094934-A1 Glufosinates, glyphosates, imidazolinones, azoles of protoporphyrinogen oxidase inhibitors, cyclohexanediones, heteroaryloxyphenoxypropionic acids, and foliar- and soil-acting hebicides against mono- and di-cotyledonous PPOX, DDO, PNPO GPBAR1 1550/4885PPARG 342/4885PPARD 639/4885

“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.