⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31695129 | 0.86 | ABCB1 (0.33) | — | |
| SCHEMBL31695105 | 0.83 | ABCB1 (0.33) | — | |
| SCHEMBL30732541 | 0.83 | ABCB1 (0.33) | — | |
| SCHEMBL31695179 | 0.83 | ABCB1 (0.33) | — | |
| SCHEMBL31695203 | 0.78 | ABCB1 (0.33) | — | |
| SCHEMBL31695103 | 0.77 | ABCB1 (0.34) | — | |
| SCHEMBL31695131 | 0.76 | ABCB1 (0.31) | — | |
| SCHEMBL31695089 | 0.76 | ABCB1 (0.31) | — | |
| SCHEMBL30732524 | 0.76 | ABCB1 (0.31) | — | |
| SCHEMBL30732624 | 0.76 | ABCB1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20250313574-A1 | SIALIC ACID DERIVATIVES AND METHODS OF USING SAME | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2025-10-09 | — | — | US | disclosed |