⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20885618 | 0.77 | ALDH1A1 (0.30) | — | |
| SCHEMBL12263137 | 0.72 | DAO (0.31) | — | |
| SCHEMBL23717680 | 0.71 | PDE2A (0.33) | — | |
| SCHEMBL12263125 | 0.71 | DAO (0.33) | — | |
| SCHEMBL16593960 | 0.70 | DAO (0.39) | — | |
| SCHEMBL19296842 | 0.68 | PDE4B (0.33) | — | |
| SCHEMBL22038888 | 0.67 | — | — | |
| SCHEMBL29580649 | 0.67 | — | — | |
| SCHEMBL19434107 | 0.64 | PDE2A (0.44) | — | |
| SCHEMBL20801672 | 0.63 | SLC6A4 (0.32) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11591335-B2 | Bicyclic pesticidal compounds | BASF SE (DE) | 2023-02-28 | — | — | US | disclosed |
| US-11570992-B2 | Bicyclic compounds | BASF SE (DE) | 2023-02-07 | — | — | US | disclosed |
| US-20200165255-A1 | Bicyclic Pesticidal Compounds | BASF SE (DE) | 2020-05-28 | — | — | US | disclosed |
| EP-3453706-A1 | PESTICIDAL IMIDAZOLE COMPOUNDS | BASF SE (DE) | 2019-03-13 | — | — | EP | disclosed |