⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9718037 | 0.81 | HPGD (0.35) | — | |
| SCHEMBL9382388 | 0.73 | — | — | |
| SCHEMBL9543842 | 0.73 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL5428033 | 0.70 | TSHR (0.33) | — | |
| SCHEMBL7178426 | 0.70 | — | — | |
| SCHEMBL3868791 | 0.70 | — | — | |
| SCHEMBL7611022 | 0.69 | — | — | |
| SCHEMBL476940 | 0.67 | TSHR (0.56) | — | |
| SCHEMBL108288 | 0.67 | NPC1 (0.31) | — | |
| SCHEMBL6283701 | 0.65 | MEN1 (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0881907-A4 | CYCLIC PEPTIDE ANTIFUNGAL AGENTS | LILLY CO ELI (US) | 2000-05-10 | — | — | EP | disclosed |
| EP-0881907-A1 | CYCLIC PEPTIDE ANTIFUNGAL AGENTS | ELI LILLY AND COMPANY (US) | 1998-12-09 | — | — | EP | disclosed |
| WO-1997027864-A1 | CYCLIC PEPTIDE ANTIFUNGAL AGENTS | ELI LILLY AND COMPANY (US) | 1997-08-07 | — | — | WO | disclosed |