SCHEMBL513809

SCHEMBL513809

O=[C]NC(F)F

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL3632260 0.72
SCHEMBL8009200 0.72
SCHEMBL20899992 0.67
SCHEMBL20899874 0.67
SCHEMBL20899847 0.67
SCHEMBL513909 0.65
SCHEMBL1767123 0.62
SCHEMBL1766267 0.62
SCHEMBL6958470 0.61
SCHEMBL25210 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112625035-B 5-chlorobenzoxazole derivative or salt acceptable as pesticide, composition and application thereof 海利尔药业集团股份有限公司 2024-04-12 CN disclosed
WO-2023210623-A1 HALOALKYL SULFONE ANILIDE COMPOUND AND HERBICIDE CONTAINING SAME 株式会社エス・ディー・エス バイオテック 2023-11-02 WO disclosed
CN-116583521-A Imidazopyridazine derivatives as IL-17 modulators UCB生物制药有限责任公司 2023-08-11 CN disclosed
CN-116143784-A Acyl substituted triazol-1-yl ethanol derivative or salt acceptable as pesticide, composition and application thereof 海利尔药业集团股份有限公司 2023-05-23 CN disclosed
CN-109963922-B Aldehyde scavenger and method for removing aldehyde 东曹株式会社 2022-09-23 CN disclosed
CN-114685486-A [1,2,4] triazol-1-yl ethanol derivative or salt acceptable as pesticide, composition and application thereof 海利尔药业集团股份有限公司 2022-07-01 CN disclosed
CN-113651819-A Pyrazole carboxylic acid structural compound, salt or ester thereof and preparation method thereof 海利尔药业集团股份有限公司 2021-11-16 CN disclosed
CN-112625035-A 5-chlorobenzoxazole derivative or salt thereof acceptable as pesticide, composition and application thereof 海利尔药业集团股份有限公司 2021-04-09 CN disclosed
US-20200061225-A1 ALDEHYDE SCAVENGER AND METHOD FOR REMOVING ALDEHYDES TOSOH CORPORATION (JP) 2020-02-27 US disclosed
EP-3564334-A1 ALDEHYDE SCAVENGER AND ALDEHYDE REMOVAL METHOD Tosoh Corporation (JP) 2019-11-06 EP disclosed
WO-2005049581-A1 PYRIDAZIN-3 (2H) -ONE DERIVATIVES AND THEIR USE AS PDE4 INHIBITORS ALMIRALL PRODESFARMA, S.A. (ES) 2005-06-02 WO disclosed
WO-2004058729-A1 NEW PYRIDAZIN-3(2H)-ONE DERIVATIVES ALMIRALL PRODESFARMA SA (ES) 2004-07-15 WO disclosed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed
US-6083879-A Herbicidal benzoylisothiazoles BASF AKTIENGESELLSCHAFT (DE) 2000-07-04 US disclosed
US-6046137-A FOR CONTROLLING WEEDS BASF AKTIENGESELLSCHAFT (DE) 2000-04-04 US disclosed
US-5945381-A Herbicidal heterocyclically annulated benzoylisothiazoles BASF AKTIENGESELLSCHAFT (DE) 1999-08-31 US disclosed
EP-0898570-A1 HERBICIDAL HETEROCYCLICALLY SUBSTITUTED BENZOYLISOTHIAZOLES BASF AKTIENGESELLSCHAFT (DE) 1999-03-03 EP disclosed
EP-0897384-A1 HERBICIDAL BENZOYLISOTHIAZOLES BASF AKTIENGESELLSCHAFT (DE) 1999-02-24 EP disclosed
WO-1997038987-A1 HERBICIDAL BENZOYLISOTHIAZOLES BASF AKTIENGESELLSCHAFT (DE) 1997-10-23 WO disclosed
WO-1997038996-A1 HERBICIDAL HETEROCYCLICALLY SUBSTITUTED BENZOYLISOTHIAZOLES BASF AKTIENGESELLSCHAFT (DE) 1997-10-23 WO disclosed