⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL46015 | 0.91 | — | — | |
| SCHEMBL46162 | 0.91 | MEN1 (0.31) | — | |
| SCHEMBL46040 | 0.90 | MAPK1 (0.32) | — | |
| SCHEMBL16473161 | 0.89 | — | — | |
| SCHEMBL19139744 | 0.88 | — | — | |
| SCHEMBL46038 | 0.88 | — | — | |
| SCHEMBL37377 | 0.88 | — | — | |
| SCHEMBL37137 | 0.86 | — | — | |
| SCHEMBL46011 | 0.86 | — | — | |
| SCHEMBL46151 | 0.86 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9462808-B2 | Pesticidal compositions | SYNGENTA PARTICIPANTS AG (CH) | 2016-10-11 | — | — | US | disclosed |
| US-9462808-B2 | Pesticidal compositions | SYNGENTA PARTICIPANTS AG (CH) | 2016-10-11 | — | — | US | disclosed |
| US-20130150394-A1 | PESTICIDAL COMPOSITIONS | SYNGENTA CROP PROTECTION LLC (US) | 2013-06-13 | — | — | US | disclosed |