⚠ 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1187490 | 1.00 | — | — | |
| SCHEMBL7810426 | 0.77 | — | — | |
| SCHEMBL776674 | 0.73 | — | — | |
| SCHEMBL11281377 | 0.73 | — | — | |
| SCHEMBL45153 | 0.71 | — | — | |
| Propene SCHEMBL11030725 | 0.71 | — | — | |
| Ammonia Solution, Strong SCHEMBL27794631 | 0.68 | — | — | |
| SCHEMBL9945303 | 0.67 | — | — | |
| SCHEMBL12854102 | 0.67 | — | — | |
| SCHEMBL4168611 | 0.67 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112236421-B | Pyrazole derivatives and pest control agents | 组合化学工业株式会社 | 2023-12-26 | — | — | CN | disclosed |
| US-7884242-B2 | N1-(6-{[3,5-bis(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-2-methylpyridin-3-yl)-3-chloro-N2-[(1S)-1-methyl-2-(methylthio)ethyl]phthalamide; pesticide; nematocide | BAYER CROPSCIENCE AG (DE) | 2011-02-08 | — | — | US | disclosed |
| US-20090023752-A1 | N-Heterocyclylphthaldiamides as Insecticides | BAYER CROPSCIENCE AG (DE) | 2009-01-22 | — | — | US | disclosed |
| EP-1814874-A1 | N-HETEROCYCLYL PHTHALIC ACID DIAMIDES AS INSECTICIDES | Bayer CropScience AG (DE) | 2007-08-08 | — | — | EP | disclosed |
| WO-2006053643-A1 | N-HETEROCYCLYL PHTHALIC ACID DIAMIDES AS INSECTICIDES | BAYER CROPSCIENCE AG (DE) | 2006-05-26 | — | — | WO | disclosed |
| EP-0409413-A2 | Diaryl ether heterocycles | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-01-23 | — | — | EP | disclosed |
| US-4468523-A | PALLADIUM, VANADIUM OXIDE, TITANIUM | ATLANTIC RICHFIELD COMPANY (US) | 1984-08-28 | — | — | US | disclosed |
| US-4454342-A | PALLADIUM, VANADIUM AND PHOSPHORUS | ATLANTIC RICHFIELD COMPANY (US) | 1984-06-12 | — | — | US | disclosed |
| US-4451666-A | Synthesis of oxalate esters by the oxidative carbonylation of alcohols with a heterogeneous manganese promoted Pd-V-P catalyst | ATLANTIC RICHFIELD COMPANY (US) | 1984-05-29 | — | — | US | disclosed |
| US-4447638-A | CATALYST SELECTIVITY | ATLANTIC RICHFIELD COMPANY (US) | 1984-05-08 | — | — | US | disclosed |
| US-4447639-A | Oxidative carbonylation of alcohols to dialkyl oxalates using a heterogeneous iron promoted Pd-V-P catalyst | ATLANTIC RICHFIELD COMPANY (US) | 1984-05-08 | — | — | US | disclosed |