⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29787613 | 0.97 | — | — | |
| SCHEMBL28835715 | 0.90 | — | — | |
| SCHEMBL30059753 | 0.87 | — | — | |
| Oxalic Acid SCHEMBL28835800 | 0.82 | — | — | |
| Lithium SCHEMBL30060188 | 0.81 | — | — | |
| Potassium SCHEMBL30061050 | 0.81 | — | — | |
| SCHEMBL28835716 | 0.79 | — | — | |
| SCHEMBL29900462 | 0.79 | TSHR (0.30) | — | |
| Oxalic Acid SCHEMBL28909878 | 0.75 | — | — | |
| Oxalic Acid SCHEMBL28885583 | 0.70 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115332635-A | Oxalic acid phosphate and preparation method and application thereof | 恒大新能源技术(深圳)有限公司 | 2022-11-11 | — | — | CN | disclosed |