⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL29829254 | 1.00 | — | — | |
| Ammonia Solution, Strong SCHEMBL30552041 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL29366864 | 0.82 | — | — | |
| Fluoride Ion SCHEMBL457749 | 0.82 | — | — | |
| Bromide SCHEMBL3741444 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL2443125 | 0.82 | — | — | |
| SCHEMBL31274849 | 0.71 | — | — | |
| SCHEMBL11035183 | 0.71 | — | — | |
| Water SCHEMBL2376164 | 0.71 | — | — | |
| SCHEMBL30800081 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118294514-B | Rapid detection method for PDS content in HPF method | 吉林省宝利科贸有限公司 | 2024-10-11 | — | — | CN | disclosed |
| CN-118294514-A | Rapid detection method for PDS content in HPF method | 吉林省宝利科贸有限公司 | 2024-07-05 | — | — | CN | disclosed |