⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23625013 | 0.76 | — | — | |
| SCHEMBL24599437 | 0.71 | — | — | |
| SCHEMBL16362673 | 0.69 | — | — | |
| SCHEMBL23278511 | 0.69 | — | — | |
| SCHEMBL18838741 | 0.69 | — | — | |
| SCHEMBL22432942 | 0.67 | — | — | |
| SCHEMBL22958641 | 0.67 | — | — | |
| SCHEMBL23099587 | 0.64 | — | — | |
| SCHEMBL23625014 | 0.64 | — | — | |
| SCHEMBL21210690 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023001069-A1 | MACROCYCLIC AMIDE COMPOUNDS AND APPLICATION THEREOF | 南京明德新药研发有限公司 | 2023-01-26 | — | — | WO | disclosed |