⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL313388 | 0.78 | — | — | |
| SCHEMBL2691144 | 0.68 | — | — | |
| SCHEMBL1683820 | 0.64 | — | — | |
| SCHEMBL3245144 | 0.63 | — | — | |
| SCHEMBL17104896 | 0.63 | — | — | |
| SCHEMBL29774447 | 0.60 | — | — | |
| SCHEMBL1039999 | 0.60 | — | — | |
| SCHEMBL302005 | 0.60 | — | — | |
| SCHEMBL13680183 | 0.60 | — | — | |
| SCHEMBL31556619 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3030082-A1 | PYRAZOLYL PYRROLINONES AND THEIR USE AS HERBICIDES | Syngenta Participations AG (CH) | 2016-06-15 | — | — | EP | disclosed |
| WO-2015018433-A1 | PYRAZOLYL PYRROLINONES AND THEIR USE AS HERBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2015-02-12 | — | — | WO | disclosed |