⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19851939 | 0.74 | — | — | |
| SCHEMBL23346992 | 0.74 | — | — | |
| SCHEMBL23365675 | 0.72 | — | — | |
| SCHEMBL14259447 | 0.72 | — | — | |
| SCHEMBL18647838 | 0.68 | — | — | |
| SCHEMBL18542239 | 0.67 | — | — | |
| SCHEMBL22191932 | 0.67 | — | — | |
| SCHEMBL21315949 | 0.67 | — | — | |
| SCHEMBL18947598 | 0.65 | — | — | |
| Acrylamide SCHEMBL28124856 | 0.64 | ALDH1A1 (0.48) | — |
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-4272832-A2 | ANTIMICROBIAL COMPOUNDS, COMPOSITIONS, AND USES THEREOF | Lakewood Amedex, Inc. (US) | 2023-11-08 | — | — | EP | disclosed |
| US-20210139522-A1 | ANTIMICROBIAL COMPOUNDS, COMPOSITIONS, AND USES THEREOF | Lakewood Amedex, Inc. | 2021-05-13 | — | — | US | disclosed |