⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17923099 | 0.74 | — | — | |
| SCHEMBL21728519 | 0.67 | — | — | |
| SCHEMBL14992946 | 0.67 | RARA (0.39) | — | |
| SCHEMBL14992712 | 0.65 | — | — | |
| SCHEMBL9135980 | 0.65 | — | — | |
| SCHEMBL10826999 | 0.65 | — | — | |
| SCHEMBL14993398 | 0.65 | — | — | |
| SCHEMBL22110078 | 0.64 | — | — | |
| SCHEMBL19897498 | 0.61 | — | — | |
| SCHEMBL5591412 | 0.61 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4931458-A | Heterocyclic rodenticidal compounds, compositions containing the compounds, and methods of use | HOFFMANN-LA ROCHE INC. (US) | 1990-06-05 | — | — | US | disclosed |
| US-4816476-A | BENZO(B)THIENYL GROUP OR BENZOFURAN SUBSTITUTED GROUPS | HOFFMANN-LA ROCHE INC. (US) | 1989-03-28 | — | — | US | disclosed |
| EP-0098591-B1 | HETEROCYCLIC COMPOUNDS AND RODENTICIDES CONTAINING THEM | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1987-07-08 | — | — | EP | disclosed |
| US-4659735-A | Benzofuranyl (thienyl) propenyl derivatives useful as rodenticides | HOFFMANN-LA ROCHE INC. (US) | 1987-04-21 | — | — | US | disclosed |
| US-4535086-A | RODENTICIDES | HOFFMANN-LA ROCHE INC. (US) | 1985-08-13 | — | — | US | disclosed |
| EP-0116277-A2 | Ketones of bicyclic compounds, process for their preparation, odorant and/or flavouring compositions containing such compounds | L. GIVAUDAN & CIE Société Anonyme (CH) | 1984-08-22 | — | — | EP | disclosed |
| EP-0098591-A1 | Heterocyclic compounds and rodenticides containing them | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1984-01-18 | — | — | EP | disclosed |