⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11169724 | 0.87 | — | — | |
| Piperazine SCHEMBL11268084 | 0.85 | HIF1A (0.50) | — | |
| Piperazine SCHEMBL8441646 | 0.85 | — | — | |
| Aziridine SCHEMBL7074104 | 0.81 | — | — | |
| Aziridine SCHEMBL6346107 | 0.81 | — | — | |
| Aziridine SCHEMBL9284109 | 0.81 | HIF1A (0.42) | — | |
| SCHEMBL9614403 | 0.76 | HIF1A (0.56) | — | |
| SCHEMBL26047 | 0.76 | — | — | |
| SCHEMBL13671434 | 0.71 | HIF1A (0.67) | — | |
| SCHEMBL4273750 | 0.71 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0044418-B1 | PROCESS FOR THE PREPARATION OF IMIDAZOLIDINE TRIONES | BAYER AG (DE) | 1984-02-22 | — | — | EP | disclosed |
| US-4384122-A | Process for the production of imidazolidine triones | BAYER AKTIENGESELLSCHAFT (DE) | 1983-05-17 | — | — | US | disclosed |
| EP-0044418-A1 | Process for the preparation of imidazolidine triones | BAYER AG (DE) | 1982-01-27 | — | — | EP | disclosed |