⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL195069 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL27419951 | 0.95 | — | — | |
| Ammonia Solution, Strong SCHEMBL28006902 | 0.95 | — | — | |
| Chloromethane SCHEMBL27314714 | 0.92 | TSHR (0.43) | — | |
| SCHEMBL29192929 | 0.88 | GAA (0.54) | — | |
| SCHEMBL16975611 | 0.88 | MGAM (0.42) | — | |
| SCHEMBL5331962 | 0.85 | TSHR (0.48) | — | |
| SCHEMBL29790337 | 0.83 | TSHR (0.46) | — | |
| SCHEMBL1335833 | 0.83 | TSHR (0.56) | — | |
| SCHEMBL130115 | 0.80 | MGAM (0.44) | — |
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-109761800-A | The method of continuous crystallisation removing oxalic acid in glyoxalic acid production process | 兄弟科技股份有限公司 | 2019-05-17 | — | — | CN | disclosed |
| CN-109678693-A | A kind of glyoxalic acid continuous oxidation technique | 兄弟科技股份有限公司 | 2019-04-26 | — | — | CN | disclosed |