⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5972611 | 0.77 | — | — | |
| SCHEMBL6200870 | 0.73 | — | — | |
| SCHEMBL1962741 | 0.71 | ADH1B (0.32) | — | |
| Trimethylammonium SCHEMBL7199362 | 0.70 | SLC6A4 (0.33) | — | |
| SCHEMBL17706903 | 0.70 | SLC6A4 (0.33) | — | |
| SCHEMBL1960946 | 0.68 | — | — | |
| SCHEMBL1961338 | 0.68 | — | — | |
| SCHEMBL7161883 | 0.68 | SLC6A4 (0.32) | — | |
| SCHEMBL7161881 | 0.68 | SLC6A4 (0.32) | — | |
| SCHEMBL278175 | 0.68 | TSHR (0.42) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0903347-A1 | NOVEL CYCLIC DEPSIPEPTIDE PF1022 DERIVATIVES | MEIJI SEIKA KAISHA LTD. (JP) | 1999-03-24 | — | — | EP | claimed |
| EP-0903347-A1 | NOVEL CYCLIC DEPSIPEPTIDE PF1022 DERIVATIVES | MEIJI SEIKA KAISHA LTD. (JP) | 1999-03-24 | — | — | EP | disclosed |