⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1306770 | 0.78 | — | — | |
| SCHEMBL16324771 | 0.78 | — | — | |
| SCHEMBL28150172 | 0.75 | FDPS (0.34) | — | |
| SCHEMBL7054975 | 0.74 | — | — | |
| SCHEMBL1744917 | 0.73 | — | — | |
| SCHEMBL2444396 | 0.73 | — | — | |
| SCHEMBL1777383 | 0.73 | — | — | |
| SCHEMBL1904553 | 0.73 | — | — | |
| SCHEMBL7529827 | 0.69 | — | — | |
| SCHEMBL5713341 | 0.68 | DAO (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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-58183672-A | — | — | None | — | — | JP | disclosed |
| EP-0080051-B1 | HETEROCYCLIC COMPOUNDS AND ANTIBACTERIAL AND ANTIFUNGAL COMPOSITIONS CONTAINING THE SAME AS ACTIVE INGREDIENTS | MEIJI SEIKA KAISHA LTD. (JP) | 1986-02-05 | — | — | EP | disclosed |
| US-4563472-A | BACTERICIDES, FUNGICIDES | MEIJI SEIKA KAISHA, LTD. (JP) | 1986-01-07 | — | — | US | disclosed |
| JP-S58183672-A | IODOPROPARGYL COMPOUND, ITS PREPARATION AND ANTIFUNGAL AGENT CONTAINING SAID COMPOUND AS ACTIVE COMPONENT | MEIJI SEIKA KAISHA LTD | 1983-10-26 | — | — | JP | disclosed |
| EP-0080051-A2 | Heterocyclic compounds and antibacterial and antifungal compositions containing the same as active ingredients | MEIJI SEIKA KAISHA LTD. (JP) | 1983-06-01 | — | — | EP | disclosed |