⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2464585 | 0.77 | — | — | |
| SCHEMBL64073 | 0.69 | — | — | |
| SCHEMBL22715212 | 0.69 | ALDH1A1 (0.65) | — | |
| Hydrochloric Acid SCHEMBL9663276 | 0.67 | — | — | |
| SCHEMBL2202789 | 0.66 | PDPK1 (0.41) | — | |
| SCHEMBL3591108 | 0.65 | — | — | |
| SCHEMBL980632 | 0.65 | — | — | |
| SCHEMBL12556557 | 0.61 | ADORA3 (0.33) | — | |
| SCHEMBL172129 | 0.61 | ALDH1A1 (0.37) | — | |
| SCHEMBL5302407 | 0.61 | ADORA3 (0.33) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114976047-B | Catalyst for electro-oxidation of methanol and preparation method thereof | 南京大学 | 2024-08-23 | — | — | CN | claimed |
| CN-114976047-A | Catalyst for methanol electrooxidation and preparation method thereof | 南京大学 | 2022-08-30 | — | — | CN | claimed |
| CN-114976047-B | Catalyst for electro-oxidation of methanol and preparation method thereof | 南京大学 | 2024-08-23 | — | — | CN | disclosed |
| CN-114976047-A | Catalyst for methanol electrooxidation and preparation method thereof | 南京大学 | 2022-08-30 | — | — | CN | disclosed |
| EP-3226858-B1 | IMIDAZOLE-BASED ANTIMICROBIAL AGENTS | PROCOMCURE BIOTECH GMBH (AT) | 2021-02-03 | — | — | EP | disclosed |