⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30958300 | 0.85 | — | — | |
| SCHEMBL22683338 | 0.85 | — | — | |
| SCHEMBL24313964 | 0.84 | LRRK2 (0.30) | — | |
| SCHEMBL23398052 | 0.83 | — | — | |
| SCHEMBL17609333 | 0.83 | POLB (0.40) | — | |
| SCHEMBL31476242 | 0.82 | — | — | |
| SCHEMBL31476285 | 0.82 | — | — | |
| SCHEMBL31476226 | 0.81 | — | — | |
| SCHEMBL31476232 | 0.81 | — | — | |
| SCHEMBL20276043 | 0.81 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3207044-B1 | PESTICIDALLY ACTIVE TETRACYCLIC HETEROCYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS | SYNGENTA PARTICIPATIONS AG (CH) | 2018-07-25 | — | — | EP | disclosed |