⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL492281 | 0.97 | — | — | |
| SCHEMBL28527781 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL8123313 | 0.94 | — | — | |
| SCHEMBL28008809 | 0.94 | — | — | |
| SCHEMBL28529617 | 0.94 | — | — | |
| SCHEMBL28587515 | 0.81 | — | — | |
| SCHEMBL236152 | 0.69 | — | — | |
| SCHEMBL29452703 | 0.69 | — | — | |
| SCHEMBL31570731 | 0.69 | — | — | |
| SCHEMBL31384562 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108812681-B | Pesticidal compositions and methods related thereto | 美国陶氏益农公司 | 2021-02-26 | — | — | CN | claimed |
| CN-108812681-B | Pesticidal compositions and methods related thereto | 美国陶氏益农公司 | 2021-02-26 | — | — | CN | disclosed |