⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2802528 | 0.88 | — | — | |
| SCHEMBL1742914 | 0.85 | — | — | |
| SCHEMBL1743769 | 0.83 | — | — | |
| SCHEMBL2802558 | 0.83 | — | — | |
| SCHEMBL22149284 | 0.72 | CA1 (0.33) | — | |
| SCHEMBL22149279 | 0.72 | CA1 (0.33) | — | |
| SCHEMBL2804057 | 0.72 | — | — | |
| SCHEMBL2803934 | 0.69 | — | — | |
| SCHEMBL7155167 | 0.68 | LMNA (0.35) | — | |
| SCHEMBL3640773 | 0.68 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2386563-A1 | Novel O-acetylated decasaccharides | Institut Pasteur (FR) | 2011-11-16 | — | — | EP | disclosed |