⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4652882 | 0.97 | — | — | |
| SCHEMBL2369568 | 0.94 | — | — | |
| Lithium Ion SCHEMBL28561571 | 0.94 | — | — | |
| Potassium Ion SCHEMBL4744529 | 0.94 | — | — | |
| Vinyl Ether SCHEMBL30207729 | 0.71 | — | — | |
| SCHEMBL337625 | 0.65 | — | — | |
| SCHEMBL28465118 | 0.65 | LMNA (0.33) | — | |
| SCHEMBL28360054 | 0.65 | — | — | |
| SCHEMBL780071 | 0.65 | — | — | |
| SCHEMBL22800690 | 0.65 | — | — |
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-107641347-A | Polymer sulphoaluminate cement base Marine Antifouling Paint that a kind of nanometer of barium phosphate is modified and preparation method thereof | 济南大学 | 2018-01-30 | — | — | CN | claimed |
| CN-107641347-A | Polymer sulphoaluminate cement base Marine Antifouling Paint that a kind of nanometer of barium phosphate is modified and preparation method thereof | 济南大学 | 2018-01-30 | — | — | CN | disclosed |