⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9226039 | 0.76 | MEN1 (0.30) | — | |
| SCHEMBL9218926 | 0.68 | DAO (0.37) | — | |
| SCHEMBL9569277 | 0.64 | DAO (0.37) | — | |
| SCHEMBL9569308 | 0.57 | — | — | |
| SCHEMBL9257185 | 0.56 | — | — | |
| SCHEMBL3230298 | 0.55 | ALDH1A1 (0.52) | — | |
| SCHEMBL9569269 | 0.54 | — | — | |
| SCHEMBL3232289 | 0.52 | ALDH1A1 (0.52) | — | |
| SCHEMBL3221866 | 0.52 | TSHR (0.42) | — | |
| SCHEMBL3218830 | 0.52 | ALDH1A1 (0.50) | — |
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-0555153-A1 | Pyrethrinoide esters, derivatives of furan- or thiophenalcohol, process for their preparation and application thereof as pesticides | ROUSSEL UCLAF (FR) | 1993-08-11 | — | — | EP | disclosed |