⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL758883 | 0.74 | CA2 (0.41) | — | |
| SCHEMBL2085247 | 0.74 | CA2 (0.41) | — | |
| SCHEMBL758884 | 0.74 | CA2 (0.41) | — | |
| SCHEMBL160 | 0.74 | CA2 (0.41) | — | |
| SCHEMBL1345425 | 0.73 | CA1 (0.35) | — | |
| SCHEMBL6830251 | 0.71 | CA2 (0.39) | — | |
| Lithium SCHEMBL1493039 | 0.71 | CA2 (0.39) | — | |
| SCHEMBL6448264 | 0.71 | CA2 (0.39) | — | |
| SCHEMBL2471225 | 0.71 | — | — | |
| SCHEMBL6448263 | 0.71 | CA2 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020030095-A1 | PHARMACEUTICAL COMPOSITION CONTAINING META-DIAMIDE COMPOUND AND USE THEREOF | 上海泰禾国际贸易有限公司 | 2020-02-13 | — | — | WO | disclosed |
| US-5075448-A | Synthesis of swainsonine and analogs thereof | MONSANTO COMPANY (US) | 1991-12-24 | — | — | US | disclosed |
| US-5075457-A | Synthesis of swainsonine and analogs thereof | MONSANTO COMPANY (US) | 1991-12-24 | — | — | US | disclosed |
| US-5023340-A | Pyrrolizioines and synthesis thereof | MONSANTO COMPANY (US) | 1991-06-11 | — | — | US | disclosed |
| EP-0424349-A1 | Synthesis of 1,4-dideoxy-1,4-imino-D-mannitol | MONSANTO COMPANY (US) | 1991-04-24 | — | — | EP | disclosed |