⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29548483 | 1.00 | — | — | |
| SCHEMBL10773596 | 1.00 | — | — | |
| SCHEMBL30135586 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL22121297 | 0.71 | — | — | |
| Bromide SCHEMBL23326424 | 0.71 | — | — | |
| SCHEMBL23906960 | 0.71 | — | — | |
| SCHEMBL25267911 | 0.71 | — | — | |
| Water SCHEMBL21352203 | 0.71 | — | — | |
| SCHEMBL21569391 | 0.71 | — | — | |
| SCHEMBL21802058 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112504972-B | Method for rapidly monitoring nitrogen content of tobacco | 华南师范大学 | 2023-05-12 | — | — | CN | claimed |
| CN-112504972-A | Method for rapidly monitoring nitrogen content of tobacco | 华南师范大学 | 2021-03-16 | — | — | CN | claimed |
| CN-112504972-B | Method for rapidly monitoring nitrogen content of tobacco | 华南师范大学 | 2023-05-12 | — | — | CN | disclosed |
| CN-112504972-A | Method for rapidly monitoring nitrogen content of tobacco | 华南师范大学 | 2021-03-16 | — | — | CN | disclosed |