⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31695052 | 0.94 | — | — | |
| SCHEMBL26926517 | 0.84 | — | — | |
| SCHEMBL31695205 | 0.83 | NANP (0.33) | — | |
| SCHEMBL26926801 | 0.81 | NANP (0.32) | — | |
| SCHEMBL30732516 | 0.80 | — | — | |
| SCHEMBL31695161 | 0.80 | — | — | |
| SCHEMBL30732482 | 0.79 | — | — | |
| SCHEMBL31695155 | 0.75 | NANP (0.33) | — | |
| SCHEMBL31695044 | 0.71 | NANP (0.39) | — | |
| SCHEMBL26944654 | 0.71 | NANP (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023239906-A2 | SIALIC ACID DERIVATIVES AND METHODS OF USING SAME | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2023-12-14 | — | — | WO | disclosed |