⚠ 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 | |
|---|---|---|---|---|
| Hydroxyamine SCHEMBL27949209 | 0.91 | — | — | |
| SCHEMBL31313730 | 0.91 | CA1 (0.40) | — | |
| SCHEMBL7793 | 0.91 | — | — | |
| Carbamic Acid SCHEMBL27956982 | 0.87 | ACHE (0.58) | — | |
| Fluoride SCHEMBL23213374 | 0.86 | CA1 (0.36) | — | |
| Ammonia Solution, Strong SCHEMBL3392168 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL17746891 | 0.86 | — | — | |
| SCHEMBL5836397 | 0.86 | CA1 (0.36) | — | |
| SCHEMBL20942756 | 0.86 | — | — | |
| Water SCHEMBL11147383 | 0.86 | — | — |
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-110171848-A | A kind of chromium salt production method that supplies are recyclable | 中南大学 | 2019-08-27 | — | — | CN | disclosed |
| CN-104263923-B | The tungsten mineral material metallurgical technology of no pollution discharge can be achieved | 江西稀有金属钨业控股集团有限公司 | 2018-03-23 | — | — | CN | disclosed |
| CN-104263922-B | The tungsten mineral material metallurgical system of no pollution discharge can be achieved | 中南大学 | 2018-01-23 | — | — | CN | disclosed |