⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL292267 | 0.76 | — | — | |
| SCHEMBL2671479 | 0.76 | — | — | |
| SCHEMBL25003362 | 0.73 | — | — | |
| SCHEMBL8530109 | 0.73 | — | — | |
| Iodide SCHEMBL2970014 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL29893938 | 0.72 | LMNA (0.47) | — | |
| SCHEMBL27766358 | 0.72 | — | — | |
| SCHEMBL30724174 | 0.72 | — | — | |
| SCHEMBL8404899 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL6890640 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105085433-B | Substituted amide phenol compound and preparation method thereof, pharmaceutical composition and purposes | 中国科学院上海药物研究所 | 2019-06-25 | — | — | CN | disclosed |
| CN-105085433-A | Substituted-amide phenolic compound, preparation method, pharmaceutical composition and application thereof | SHANGHAI INST MATERIA MEDICA | 2015-11-25 | — | — | CN | disclosed |