SCHEMBL4736723

SCHEMBL4736723

Cn1c(C(F)(F)F)cc(=O)n(-c2cc(Oc3cccnc3[O])c(Cl)cc2F)c1=O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 13/20 0.39
BCAT2 O15382 11/20 0.39
MAT2A P31153 1/20 0.33
GRM4 Q14833 4/20 0.32
GAA P10253 1/20 0.32
ATM Q13315 1/20 0.32
DHODH Q02127 1/20 0.31

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
SCHEMBL21615919 0.92 BCAT1 (0.39) BCAT1BCAT2MAT2AGRM4GAA
SCHEMBL130065 0.91 BCAT1 (0.39) BCAT1BCAT2MAT2A
SCHEMBL2736477 0.91 BCAT1 (0.38) BCAT1BCAT2MAT2AGRM4DHODH
SCHEMBL2594502 0.91 BCAT1 (0.41) BCAT1BCAT2MAT2AGRM4DHODH
SCHEMBL10086757 0.89 BCAT1 (0.37) BCAT1BCAT2MAT2AGRM4
SCHEMBL20334530 0.88 BCAT1 (0.36) BCAT1BCAT2MAT2AATM
SCHEMBL12430766 0.88 BCAT1 (0.37) BCAT1BCAT2MAT2ADHODH
SCHEMBL10579206 0.88 BCAT1 (0.35) BCAT1BCAT2MAT2AGRM4GAA
SCHEMBL6635645 0.88 BCAT1 (0.35) BCAT1BCAT2MAT2AGRM4DHODH
SCHEMBL6642902 0.87 CYP1A2 (0.34) BCAT1BCAT2MAT2AGRM4GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4337017-A1 HERBICIDE/SAFENER COMBINATION BASED ON SAFENERS FROM THE CLASS OF SUBSTITUTED [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACIDS AND THEIR SALTS Bayer Aktiengesellschaft (DE) 2024-03-20 EP disclosed
US-20230175005-A1 PLANTS HAVING INCREASED TOLERANCE TO HERBICIDES BASF SE (DE) 2023-06-08 US disclosed
WO-2022098522-A1 HERBICIDE COMPOSITIONS WITH EPYRIFENACIL AND 2,4-D TRIETHANOLAMINE SALT WITH IMPROVED PROPERTIES MONSANTO TECHNOLOGY LLC (US) 2022-05-12 WO disclosed
EP-3993626-A1 HERBICIDAL COMPOSITIONS Bayer Aktiengesellschaft (DE) 2022-05-11 EP disclosed
WO-2021146445-A1 MICROEMULSIONS WITH DICAMBA SALTS HAVING IMPROVED PROPERTIES MONSANTO TECHNOLOGY LLC (US) 2021-07-22 WO disclosed
WO-2021001273-A1 HERBICIDAL COMPOSITIONS BAYER AKTIENGESELLSCHAFT (DE) 2021-01-07 WO disclosed
CN-110914222-A Mixtures comprising herbicides and nitrification inhibitors, such as 2- (3, 4-dimethyl-1H-pyrazol-1-yl) succinic acid (DMPSA) or 3, 4-dimethylpyrazolium glycolate (DMPG) 巴斯夫欧洲公司 2020-03-24 CN disclosed
WO-2018178039-A1 CRYSTALLINE FORMS OF ETHYL[3-[2-CHLORO-4-FLUORO-5-(1-METHYL-6-TRIFLUOROMETHYL-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN-3-YL)PHENOXY]-2-PYRIDYLOXY]ACETATE BASF SE (DE) 2018-10-04 WO disclosed
WO-2018178039-A1 CRYSTALLINE FORMS OF ETHYL[3-[2-CHLORO-4-FLUORO-5-(1-METHYL-6-TRIFLUOROMETHYL-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN-3-YL)PHENOXY]-2-PYRIDYLOXY]ACETATE BASF SE (DE) 2018-10-04 WO disclosed
US-10087460-B2 Transgenic or non-transgenic plants with mutated protoporphyrinogen oxidase having increased tolerance to herbicides BASF Agro B.V. (NL) 2018-10-02 US disclosed
WO-2018043764-A3 METHOD FOR CONTROLLING HARMFUL ORGANISMS IN CROPS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-04-12 WO disclosed
WO-2018043764-A2 METHOD FOR CONTROLLING HARMFUL ORGANISMS IN CROPS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-03-08 WO disclosed
US-20160194655-A1 PLANTS HAVING INCREASED TOLERANCE TO HERBICIDES BASF Agro B.V. (NL) 2016-07-07 US disclosed
EP-2858497-A2 CROP ENHANCEMENT COMPOSITIONS Syngenta Participations AG (CH) 2015-04-15 EP disclosed
WO-2013186040-A2 CROP ENHANCEMENT COMPOSITIONS SYNGENTA PARTICIPATIONS AG (CH) 2013-12-19 WO disclosed
CN-102822179-A Pyrazinothiazines having herbicidal action BASF SE 2012-12-12 CN disclosed
CN-102822178-A Pyridothiazines having herbicidal action BASF SE 2012-12-12 CN disclosed
CN-102812024-A Substituted pyridines having herbicidal action BASF SE 2012-12-05 CN disclosed
CN-102459277-A Substituted pyrazino (thio) pyrans with herbicidal action BASF SE 2012-05-16 CN disclosed
WO-2008074991-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2008-06-26 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 (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-20230175005-A1 PLANTS HAVING INCREASED TOLERANCE TO HERBICIDES PPOX, PNPO, PAOX BCAT1 665/4885BCAT2 901/4885MAT2A 367/4885

“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.