⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22140865 | 0.74 | — | — | |
| SCHEMBL27355779 | 0.67 | — | — | |
| SCHEMBL15617563 | 0.62 | PDE4D (0.35) | — | |
| SCHEMBL24265031 | 0.61 | GMNN (0.34) | — | |
| SCHEMBL22779435 | 0.61 | DHFR (0.33) | — | |
| SCHEMBL22779432 | 0.59 | ADORA2A (0.30) | — | |
| SCHEMBL22969970 | 0.56 | MEN1 (0.36) | — | |
| SCHEMBL18729634 | 0.56 | — | — | |
| SCHEMBL2686433 | 0.56 | — | — | |
| SCHEMBL18729637 | 0.56 | — | — |
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-3592430-B1 | ANTIMICROBIAL COMPOUNDS, COMPOSITIONS, AND USES THEREOF | LAKEWOOD AMEDEX INC (US) | 2024-06-26 | — | — | EP | disclosed |