⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27874388 | 0.72 | — | — | |
| SCHEMBL17687707 | 0.71 | EPHX1 (0.52) | — | |
| SCHEMBL27874424 | 0.70 | ALDH1A1 (0.36) | — | |
| SCHEMBL7397519 | 0.70 | L3MBTL1 (0.44) | — | |
| SCHEMBL2135681 | 0.69 | HTT (0.35) | — | |
| SCHEMBL2723454 | 0.69 | — | — | |
| SCHEMBL27857734 | 0.68 | CYP3A4 (0.43) | — | |
| SCHEMBL28251458 | 0.67 | — | — | |
| SCHEMBL21495119 | 0.67 | — | — | |
| SCHEMBL27857716 | 0.67 | TSHR (0.31) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114401633-A | Pest control method, pest control agent composition, and pest control agent set | 日本曹达株式会社 | 2022-04-26 | — | — | CN | claimed |
| WO-2018125819-A1 | PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS | DOW AGROSCIENCES LLC (US) | 2018-07-05 | — | — | WO | disclosed |
| EP-3060047-A1 | PESTICIDAL COMPOSITIONS AND RELATED METHODS | Dow AgroSciences, LLC (US) | 2016-08-31 | — | — | EP | disclosed |
| EP-3057425-A1 | PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS | Dow AgroSciences LLC (US) | 2016-08-24 | — | — | EP | disclosed |
| WO-2015061157-A1 | PESTICIDAL COMPOSITIONS AND RELATED METHODS | DOW AGROSCIENCES LLC (US) | 2015-04-30 | — | — | WO | disclosed |
| WO-2015058024-A1 | PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS | DOW AGROSCIENCES LLC (US) | 2015-04-23 | — | — | WO | disclosed |