⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17901811 | 0.85 | POLB (0.36) | — | |
| SCHEMBL20847336 | 0.84 | — | — | |
| SCHEMBL19755915 | 0.84 | POLB (0.37) | — | |
| SCHEMBL20847521 | 0.83 | — | — | |
| SCHEMBL20847335 | 0.81 | POLB (0.36) | — | |
| SCHEMBL14684616 | 0.79 | POLB (0.43) | — | |
| SCHEMBL29431612 | 0.79 | POLB (0.43) | — | |
| SCHEMBL20847450 | 0.79 | — | — | |
| SCHEMBL14677213 | 0.79 | POLB (0.38) | — | |
| SCHEMBL22189258 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10385048-B2 | Pesticidally active polycyclic derivatives with sulfur containing substituents | SYNGENTA PARTICIPATION AG (CH) | 2019-08-20 | — | — | US | disclosed |
| WO-2016107831-A1 | PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS | SYNGENTA CROP PROTECTION AG (CH) | 2016-07-07 | — | — | WO | disclosed |