⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3362811 | 0.85 | — | — | |
| Phosphonic Acid SCHEMBL8385668 | 0.82 | — | — | |
| SCHEMBL220514 | 0.79 | — | — | |
| SCHEMBL9000832 | 0.78 | MEN1 (0.55) | — | |
| SCHEMBL20958122 | 0.76 | — | — | |
| SCHEMBL28334389 | 0.76 | — | — | |
| SCHEMBL28332402 | 0.76 | — | — | |
| SCHEMBL27818478 | 0.76 | — | — | |
| SCHEMBL4164486 | 0.75 | — | — | |
| SCHEMBL25256307 | 0.72 | MEN1 (0.38) | — |
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-117916299-A | Zirconia and titania formulations and nanocomposites for nanoimprint lithography | PT SPE塞博康有限责任公司 | 2024-04-19 | — | — | CN | disclosed |