⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15505954 | 0.87 | CETP (0.44) | — | |
| SCHEMBL31057956 | 0.83 | KDM4E (0.41) | — | |
| SCHEMBL15505957 | 0.83 | MMP13 (0.36) | — | |
| SCHEMBL31053600 | 0.81 | MMP9 (0.41) | — | |
| SCHEMBL8567866 | 0.77 | — | — | |
| SCHEMBL3622465 | 0.74 | — | — | |
| SCHEMBL5523419 | 0.74 | — | — | |
| SCHEMBL26101343 | 0.74 | — | — | |
| SCHEMBL16028754 | 0.72 | FFAR3 (0.50) | — | |
| Hydrochloric Acid SCHEMBL21853138 | 0.72 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115151252-B | Iron death inhibitor-diarylamine acetamides | 维泰瑞隆有限公司 | 2024-08-27 | — | — | CN | disclosed |
| WO-2011147951-A1 | CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS | PROSIDION LIMITED (GB) | 2011-12-01 | — | — | WO | disclosed |
| WO-2008140781-A1 | SPIRO COMPOUNDS FOR TREATMENT OF INFLAMMATORY DISORDERS | ATHEROGENICS, INC. (US) | 2008-11-20 | — | — | WO | disclosed |