⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30767719 | 1.00 | — | — | |
| SCHEMBL29349963 | 1.00 | — | — | |
| SCHEMBL3089195 | 1.00 | — | — | |
| SCHEMBL11781120 | 1.00 | — | — | |
| SCHEMBL30820033 | 1.00 | — | — | |
| SCHEMBL958228 | 0.82 | — | — | |
| SCHEMBL9949172 | 0.82 | — | — | |
| SCHEMBL10558664 | 0.82 | — | — | |
| SCHEMBL952923 | 0.82 | — | — | |
| SCHEMBL1171863 | 0.82 | — | — |
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-118191262-A | Method for detecting nitrogen content in aluminum-iron alloy | 攀钢集团西昌钢钒有限公司 | 2024-06-14 | — | — | CN | claimed |
| CN-118191262-A | Method for detecting nitrogen content in aluminum-iron alloy | 攀钢集团西昌钢钒有限公司 | 2024-06-14 | — | — | CN | disclosed |
| US-6033552-A | Method for purification of natrium sulphate | KHALEMSKY ARON MIKHAILOVICH (RU) | 2000-03-07 | — | — | US | disclosed |