⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22322466 | 0.79 | PABPC1 (0.35) | — | |
| SCHEMBL22345471 | 0.78 | HSP90AA1 (0.33) | — | |
| SCHEMBL22322496 | 0.77 | — | — | |
| SCHEMBL22335317 | 0.77 | P4HTM (0.30) | — | |
| SCHEMBL22345259 | 0.77 | CYP2D6 (0.33) | — | |
| SCHEMBL22322458 | 0.76 | ALDH1A1 (0.35) | — | |
| Hydrochloric Acid SCHEMBL22322470 | 0.76 | FFAR1 (0.32) | — | |
| SCHEMBL22322468 | 0.76 | — | — | |
| Trifluoroacetic Acid SCHEMBL22322511 | 0.71 | HTT (0.32) | — | |
| SCHEMBL22345465 | 0.70 | HSP90AA1 (0.35) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220142164-A1 | HERBICIDAL COMPOUNDS | SYNGENTA CROP PROTECTION AG (CH) | 2022-05-12 | — | — | US | disclosed |
| EP-3923728-A1 | HERBICIDAL COMPOUNDS | Syngenta Crop Protection AG (CH) | 2021-12-22 | — | — | EP | disclosed |
| CN-113423274-A | Herbicidal compounds | 先正达农作物保护股份公司 | 2021-09-21 | — | — | CN | disclosed |
| WO-2020165321-A1 | HERBICIDAL COMPOUNDS | SYNGENTA CROP PROTECTION AG (CH) | 2020-08-20 | — | — | WO | disclosed |