⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6881576 | 0.86 | — | — | |
| SCHEMBL9300828 | 0.85 | CA9 (0.41) | — | |
| SCHEMBL29524871 | 0.85 | CA9 (0.41) | — | |
| SCHEMBL5487754 | 0.85 | CA9 (0.41) | — | |
| SCHEMBL24603577 | 0.85 | CA9 (0.41) | — | |
| SCHEMBL24415130 | 0.85 | CA9 (0.41) | — | |
| SCHEMBL9300509 | 0.85 | CA9 (0.41) | — | |
| SCHEMBL29551166 | 0.81 | CA12 (0.36) | — | |
| SCHEMBL1726763 | 0.80 | F11 (0.40) | — | |
| SCHEMBL1357858 | 0.80 | F11 (0.40) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1421100-B1 | CHEMICAL SYNTHESIS OF SOLAMARGINE | GLYCOMED SCIENCES LTD (KY) | 2008-07-09 | — | — | EP | claimed |
| US-20040259814-A1 | Synthesis of solanum glycosides | GLYCOMED SCIENCES LIMITED (KY) | 2004-12-23 | — | — | US | claimed |
| EP-1421100-A1 | CHEMICAL SYNTHESIS OF SOLAMARGINE | GlycoMed Sciences Limited (AU) | 2004-05-26 | — | — | EP | claimed |
| WO-2003018604-A1 | SYNTHESIS OF SOLANUM GLYCOSIDES | GLYCOMED SCIENCES LIMITED (AU) | 2003-03-06 | — | — | WO | claimed |
| EP-1421100-B1 | CHEMICAL SYNTHESIS OF SOLAMARGINE | GLYCOMED SCIENCES LTD (KY) | 2008-07-09 | — | — | EP | disclosed |
| US-20040259814-A1 | Synthesis of solanum glycosides | GLYCOMED SCIENCES LIMITED (KY) | 2004-12-23 | — | — | US | disclosed |