⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2722702 | 0.89 | — | — | |
| SCHEMBL5487431 | 0.89 | — | — | |
| SCHEMBL29192722 | 0.80 | — | — | |
| SCHEMBL15844120 | 0.80 | — | — | |
| SCHEMBL27975761 | 0.80 | — | — | |
| SCHEMBL28760520 | 0.80 | — | — | |
| SCHEMBL6015092 | 0.80 | — | — | |
| SCHEMBL29092086 | 0.80 | — | — | |
| SCHEMBL15346155 | 0.80 | — | — | |
| SCHEMBL28300101 | 0.80 | — | — |
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-117899854-A | Preparation method of denitration catalyst | 胡国鑫 | 2024-04-19 | — | — | CN | disclosed |
| CN-117839681-A | Preparation method of high-stability denitration catalyst | 胡国鑫 | 2024-04-09 | — | — | CN | disclosed |
| CN-117839682-A | Integral denitration catalyst | 胡国鑫 | 2024-04-09 | — | — | CN | disclosed |