⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24160277 | 0.86 | TP53 (0.30) | — | |
| SCHEMBL24160064 | 0.81 | ALDH1A1 (0.32) | — | |
| SCHEMBL24160612 | 0.80 | ALDH1A1 (0.32) | — | |
| SCHEMBL24830075 | 0.79 | CNR2 (0.32) | — | |
| SCHEMBL24160672 | 0.79 | LMNA (0.31) | — | |
| SCHEMBL24160755 | 0.78 | KDM4E (0.38) | — | |
| SCHEMBL24159972 | 0.78 | TP53 (0.30) | — | |
| SCHEMBL23298737 | 0.78 | KDM4E (0.35) | — | |
| SCHEMBL24160437 | 0.77 | NPSR1 (0.39) | — | |
| SCHEMBL23298823 | 0.75 | KDM4E (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3932922-A1 | SULFUR-CONTAINING COMPOUND BASED ON GLUTARIMIDE SKELETON AND APPLICATION THEREOF | ShanghaiTech University (CN) | 2022-01-05 | — | — | EP | disclosed |