SCHEMBL4475149

SCHEMBL4475149

O=C(NS(=O)(=O)c1ccc(NC(=O)C2CCC2)cc1)c1ccccc1OC(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.48
LMNA P02545 1/20 0.48
AVPR2 P30518 1/20 0.47
GPR27 Q9NS67 1/20 0.47
ENPP3 O14638 10/20 0.46
ENPP1 P22413 8/20 0.46
ENPP2 Q13822 7/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44

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
SCHEMBL4477116 0.96 LIPE (0.50) LIPELMNAAVPR2GPR27ENPP3
SCHEMBL4463018 0.86 MEN1 (0.57) LMNARXFP1MEN1ALDH1A1KMT2A
SCHEMBL7798059 0.84 MEN1 (0.60) LMNAENPP3ENPP1ENPP2RXFP1
SCHEMBL4463047 0.83 AVPR2 (0.52) LMNAAVPR2GPR27ALDH1A1
SCHEMBL4468235 0.82 MAPT (0.61) RXFP1MEN1ALDH1A1GAAKMT2A
SCHEMBL4484204 0.80 RBP4 (0.49) LMNAAVPR2GPR27ENPP3ENPP1
SCHEMBL4485832 0.77 FLT1 (0.65) LMNAL3MBTL1RXFP1MEN1GAA
SCHEMBL27555511 0.77 LIPE (0.49) LIPELMNAAVPR2GPR27ENPP3
SCHEMBL18960368 0.70 EPHX2 (0.64) LIPELMNAENPP3ENPP1ENPP2
SCHEMBL4753755 0.69 KCNK3 (0.72) LMNAAVPR2GPR27RXFP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7605111-B2 Herbicides SYNGENTA CROP PROTECTION, INC. (US) 2009-10-20 US disclosed
US-7459414-B2 Herbicides SYNGENTA CROP PROTECTION, INC. (US) 2008-12-02 US disclosed
US-20080200336-A1 HERBICIDAL COMPOSITION SYNEGENTA CROP PROTECTION, INC. (US) 2008-08-21 US disclosed
EP-1481970-B1 Novel herbicides SYNGENTA PARTICIPATIONS AG (CH) 2006-03-22 EP disclosed
US-6962894-B1 comprise a herbicide and a safener (counter-agent, antidote) and protect the useful plants, but not the weeds, against the phytotoxic action of the herbicide SYNGENTA CROP PROTECTION, INC. (US) 2005-11-08 US disclosed
US-20050187110-A1 mixtures with plant safening agents used for selectively controlling weeds and grasses in crops of useful plants MAETZKE THOMAS (CH) 2005-08-25 US disclosed
US-20050164886-A1 Herbicidal compositions ALSONS CORPORATION 2005-07-28 US disclosed
US-20050164883-A1 agronomically tolerable salts, isomers and enantiomers of those compounds, are suitable for use as herbicides MAETZKE THOMAS (CH) 2005-07-28 US disclosed
US-6894005-B1 Heterocyclic compound containing phenyl groups; postemergence herbicides SYNGENTA CROP PROTECTION, INC. (US) 2005-05-17 US disclosed
US-20050090399-A1 Phenyl substituted heterocyclic compounds useful as herbicides FRIEDMANN ADRIAN A (GB) 2005-04-28 US disclosed
EP-1481970-A1 Novel herbicides Syngenta Participations AG (CH) 2004-12-01 EP disclosed
EP-1210333-B1 p-Tolyl-heterocycles as herbicides SYNGENTA PARTICIPATIONS AG (CH) 2004-11-17 EP disclosed
EP-1468000-A1 PHENYL SUBSTITUTED HETEROCYCLIC COMPOUNDS USEFUL AS HERBICIDES Syngenta Participations AG (CH) 2004-10-20 EP disclosed
WO-2003062244-A1 PHENYL SUBSTITUTED HETEROCYCLIC COMPOUNDS USEFUL AS HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2003-07-31 WO disclosed
EP-1209975-A1 HERBICIDAL COMPOSITION Syngenta Participations AG (CH) 2002-06-05 EP disclosed
EP-1210333-A2 NOVEL HERBICIDES Syngenta Participations AG (CH) 2002-06-05 EP disclosed
WO-2001017972-A2 NOVEL HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2001-03-15 WO disclosed
WO-2001017353-A1 HERBICIDAL COMPOSITION SYNGENTA PARTICIPATIONS AG (CH) 2001-03-15 WO 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 (5 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-20050164886-A1 Herbicidal compositions CBR3, CBR1, CNPY2 LIPE 3501/4885LMNA 4117/4885AVPR2 3553/4885
US-20050164883-A1 agronomically tolerable salts, isomers and enantiomers of those compounds, are suitable for use as herbicides DDT, SULT2A1, GSTA1 LIPE 811/4885LMNA 4616/4885AVPR2 542/4885
US-20080200336-A1 HERBICIDAL COMPOSITION MTX2, DDT, AGPS LIPE 366/4885LMNA 3642/4885AVPR2 1936/4885
US-20050090399-A1 Phenyl substituted heterocyclic compounds useful as herbicides DDT, PAH, CYP1A1 LIPE 1137/4885LMNA 4034/4885AVPR2 1754/4885
US-20050187110-A1 mixtures with plant safening agents used for selectively controlling weeds and grasses in crops of useful plants PIN1, GMDS, DDT LIPE 1205/4885LMNA 3710/4885AVPR2 860/4885

“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.