⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14837530 | 0.90 | PIK3CD (0.52) | — | |
| SCHEMBL21383815 | 0.85 | PIK3CD (0.56) | — | |
| SCHEMBL868824 | 0.82 | — | — | |
| SCHEMBL14749923 | 0.82 | — | — | |
| SCHEMBL14749920 | 0.82 | — | — | |
| SCHEMBL10392279 | 0.80 | — | — | |
| SCHEMBL13069654 | 0.80 | — | — | |
| SCHEMBL5312378 | 0.79 | PIK3CD (0.55) | — | |
| SCHEMBL6548967 | 0.79 | ACE (0.59) | — | |
| SCHEMBL8819173 | 0.79 | PIK3CD (0.64) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-119409718-B | Method for treating alpha-pyrrolidone rectification residues | 山东旺源新材料有限公司 | 2025-05-02 | — | — | CN | disclosed |
| CN-119409718-A | Method for treating alpha-pyrrolidone rectification residues | 山东旺源新材料有限公司 | 2025-02-11 | — | — | CN | disclosed |