SCHEMBL3247630

SCHEMBL3247630

CC(=O)OOc1ncccc1Oc1cc(-n2c(=O)cc(C(F)(F)F)n(C)c2=O)c(F)cc1Cl

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 5/20 0.34
BCAT2 O15382 4/20 0.34
MAPK8 P45983 1/20 0.32
CYP3A4 P08684 2/20 0.32
UGCG Q16739 2/20 0.32
P2RY1 P47900 1/20 0.32
MAT2A P31153 1/20 0.31
PDE4B Q07343 2/20 0.31
PDE4D Q08499 2/20 0.31
GPBAR1 Q8TDU6 1/20 0.31
DHODH Q02127 4/20 0.31
HTR2A P28223 2/20 0.31
HTR2C P28335 2/20 0.31
HTR2B P41595 2/20 0.31
SCN9A Q15858 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
SCHEMBL7639795 0.92 BCAT1 (0.35) BCAT1BCAT2MAPK8CYP3A4UGCG
SCHEMBL27873674 0.90 BCAT1 (0.33) BCAT1BCAT2MAPK8CYP3A4UGCG
SCHEMBL6641668 0.89 BCAT1 (0.34) BCAT1BCAT2MAPK8CYP3A4UGCG
SCHEMBL2594502 0.89 BCAT1 (0.41) BCAT1BCAT2MAPK8CYP3A4UGCG
SCHEMBL3248252 0.88 BCAT1 (0.39) BCAT1BCAT2DHODH
SCHEMBL26113051 0.88 BCAT1 (0.34) BCAT1BCAT2MAPK8CYP3A4UGCG
SCHEMBL26113058 0.87 DHODH (0.34) BCAT1BCAT2MAPK8CYP3A4UGCG
SCHEMBL5546904 0.87 BCAT2 (0.33) BCAT1BCAT2
SCHEMBL22912498 0.87 MAPK8 (0.35) BCAT1BCAT2MAPK8CYP3A4UGCG
Acetic Acid SCHEMBL26912024 0.87 BCAT1 (0.34) BCAT1BCAT2MAPK8CYP3A4UGCG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025128414-A1 TRANSGENIC SOYBEAN EVENT GM_CSM63717 AND COMPOSITIONS AND METHODS FOR DETECTION AND USES THEREOF MONSANTO TECHNOLOGY LLC (US) 2025-06-19 WO claimed
US-11998004-B2 Agricultural compositions and methods of use thereof VALENT U.S.A., LLC (US) 2024-06-04 US claimed
EP-3890488-B1 HERBICIDAL COMBINATIONS BAYER AG (DE) 2023-01-04 EP claimed
WO-2022098522-A1 HERBICIDE COMPOSITIONS WITH EPYRIFENACIL AND 2,4-D TRIETHANOLAMINE SALT WITH IMPROVED PROPERTIES MONSANTO TECHNOLOGY LLC (US) 2022-05-12 WO claimed
EP-3993626-A1 HERBICIDAL COMPOSITIONS Bayer Aktiengesellschaft (DE) 2022-05-11 EP claimed
EP-3890489-A1 HERBICIDE COMPOSITIONS Bayer Aktiengesellschaft (DE) 2021-10-13 EP claimed
EP-3890488-A1 HERBICIDAL COMPOSITIONS Bayer Aktiengesellschaft (DE) 2021-10-13 EP claimed
EP-3873210-A1 COMPOSITIONS COMPRISING HALAUXIFEN AND OTHER HERBICIDES AND METHODS THEREOF Dow AgroSciences, LLC (US) 2021-09-08 EP claimed
WO-2021039893-A1 HERBICIDAL AGENT COMPOSITION AND WEED CONTROL METHOD 住友化学株式会社 2021-03-04 WO claimed
WO-2021001273-A1 HERBICIDAL COMPOSITIONS BAYER AKTIENGESELLSCHAFT (DE) 2021-01-07 WO claimed
WO-2020114934-A1 HERBICIDE COMPOSITIONS BAYER AKTIENGESELLSCHAFT (DE) 2020-06-11 WO claimed
WO-2020114932-A1 HERBICIDAL COMPOSITIONS BAYER AKTIENGESELLSCHAFT (DE) 2020-06-11 WO claimed
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
WO-2024047605-A1 METHODS AND COMPOSITIONS FOR PPO HERBICIDE TOLERANCE SESVanderHave NV (BE) 2024-03-07 WO disclosed
US-20230389547-A1 HERBICIDE COMPOSITIONS WITH EPYRIFENACIL AND 2,4-D TRIETHANOLAMINE SALT WITH IMPROVED PROPERTIES MONSANTO TECHNOLOGY LLC 2023-12-07 US disclosed
US-20230320362-A1 COMPOSITION AND METHOD FOR WEED AND GRASS CONTROL ROYAL BANK OF CANADA (CA) 2023-10-12 US disclosed
CN-102741219-A Insecticidal compounds SYNGENTA PARTICIPATIONS AG 2012-10-17 CN disclosed
EP-1736052-B1 Stem/leaf desiccant SUMITOMO CHEMICAL CO (JP) 2010-04-21 EP disclosed
EP-1736052-A2 Stem/leaf desiccant Sumitomo Chemical Company, Limited (JP) 2006-12-27 EP disclosed
WO-2002098227-A1 PLANT GROWTH REGULATORS FOR COTTON HERVEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-12-12 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 (2 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-20230320362-A1 COMPOSITION AND METHOD FOR WEED AND GRASS CONTROL NOTUM, HDHD5, DDT BCAT1 1748/4885BCAT2 1384/4885MAPK8 4611/4885
US-20230389547-A1 HERBICIDE COMPOSITIONS WITH EPYRIFENACIL AND 2,4-D TRIETHANOLAMINE SALT WITH IMPROVED PROPERTIES DDT, PTMS, CHRM2 BCAT1 2651/4885BCAT2 863/4885MAPK8 2393/4885

“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.