⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22247170 | 0.77 | — | — | |
| SCHEMBL13906604 | 0.76 | — | — | |
| SCHEMBL21985062 | 0.71 | ANPEP (0.36) | — | |
| SCHEMBL15998123 | 0.71 | — | — | |
| SCHEMBL8236751 | 0.70 | — | — | |
| SCHEMBL27377802 | 0.70 | — | — | |
| SCHEMBL24514583 | 0.70 | — | — | |
| SCHEMBL20333184 | 0.69 | — | — | |
| SCHEMBL23710539 | 0.67 | EPHX1 (0.48) | — | |
| SCHEMBL25043909 | 0.67 | — | — |
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-3116887-B1 | CARBOHYDRATE LIGANDS THAT BIND TO IGM ANTIBODIES AGAINST MYELIN-ASSOCIATED GLYCOPROTEIN | UNIV BASEL (CH) | 2021-02-17 | — | — | EP | disclosed |