⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL37251 | 0.92 | ALDH1A1 (0.32) | — | |
| SCHEMBL46165 | 0.90 | ALDH1A1 (0.33) | — | |
| SCHEMBL12070203 | 0.89 | ALDH1A1 (0.32) | — | |
| SCHEMBL46090 | 0.89 | P2RY12 (0.31) | — | |
| SCHEMBL14998142 | 0.87 | — | — | |
| SCHEMBL12071040 | 0.87 | POLB (0.32) | — | |
| SCHEMBL46035 | 0.86 | ALDH1A1 (0.31) | — | |
| SCHEMBL14834182 | 0.86 | — | — | |
| SCHEMBL46065 | 0.85 | ALDH1A1 (0.34) | — | |
| SCHEMBL45928 | 0.84 | POLB (0.33) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130210625-A1 | SPIROHETEROCYCLIC PYRROLIDINE DERIVATIVES BASED PESTICIDES | SYNGENTA CROP PROTECTION LLC (US) | 2013-08-15 | — | — | US | disclosed |
| US-20130210625-A1 | SPIROHETEROCYCLIC PYRROLIDINE DERIVATIVES BASED PESTICIDES | SYNGENTA CROP PROTECTION LLC (US) | 2013-08-15 | — | — | US | disclosed |
| US-20130210625-A1 | SPIROHETEROCYCLIC PYRROLIDINE DERIVATIVES BASED PESTICIDES | SYNGENTA CROP PROTECTION LLC (US) | 2013-08-15 | — | — | US | disclosed |
| WO-2013079672-A1 | HERBICIDAL USES OF SUBSTITUTED SPIROHETEROCYCLIC PYRROLIDINE DIONE DERIVATIVES, AND HERBICIDAL COMPOSITIONS COMPRISING THEM | SYNGENTA LIMITED (GB) | 2013-06-06 | — | — | WO | disclosed |
| WO-2013079672-A1 | HERBICIDAL USES OF SUBSTITUTED SPIROHETEROCYCLIC PYRROLIDINE DIONE DERIVATIVES, AND HERBICIDAL COMPOSITIONS COMPRISING THEM | SYNGENTA LIMITED (GB) | 2013-06-06 | — | — | WO | disclosed |
| EP-2576511-A1 | SPIROHETEROCYCLIC PYRROLIDINE DERIVATIVES BASED PESTICIDES | Syngenta Participations AG (CH) | 2013-04-10 | — | — | EP | disclosed |
| WO-2011151199-A1 | SPIROHETEROCYCLIC PYRROLIDINE DERIVATIVES BASED PESTICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2011-12-08 | — | — | WO | disclosed |
| WO-2011151199-A1 | SPIROHETEROCYCLIC PYRROLIDINE DERIVATIVES BASED PESTICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2011-12-08 | — | — | WO | disclosed |