⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL285606 | 0.78 | — | — | |
| SCHEMBL262787 | 0.78 | — | — | |
| SCHEMBL5245907 | 0.75 | — | — | |
| Water SCHEMBL22042655 | 0.75 | — | — | |
| SCHEMBL28938102 | 0.66 | — | — | |
| SCHEMBL20228896 | 0.64 | HIF1A (0.35) | — | |
| SCHEMBL11468838 | 0.64 | MEN1 (0.37) | — | |
| SCHEMBL9413479 | 0.63 | — | — | |
| SCHEMBL2162628 | 0.63 | — | — | |
| SCHEMBL693531 | 0.63 | — | — |
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-0973936-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 2000-01-26 | — | — | EP | disclosed |
| WO-1998046786-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 1998-10-22 | — | — | WO | disclosed |