⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13620112 | 0.83 | — | — | |
| SCHEMBL1971530 | 0.82 | — | — | |
| SCHEMBL477040 | 0.76 | LMNA (0.30) | — | |
| SCHEMBL9493383 | 0.73 | LMNA (0.35) | — | |
| SCHEMBL1972479 | 0.73 | — | — | |
| SCHEMBL1271519 | 0.71 | LMNA (0.35) | — | |
| Perflisopent SCHEMBL814397 | 0.71 | LMNA (0.35) | — | |
| SCHEMBL9538344 | 0.71 | LMNA (0.35) | — | |
| SCHEMBL5334915 | 0.71 | LMNA (0.40) | — | |
| SCHEMBL1975277 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-114835620-A | Application of alpha-diazoate and carboxylic acid ester-forming reaction in connection of polypeptide and modification of protein | 南开大学 | 2022-08-02 | — | — | CN | claimed |