⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28247055 | 0.95 | — | — | |
| SCHEMBL28247754 | 0.93 | — | — | |
| SCHEMBL4019107 | 0.91 | — | — | |
| SCHEMBL17637543 | 0.91 | — | — | |
| SCHEMBL9006968 | 0.91 | — | — | |
| SCHEMBL28247065 | 0.85 | — | — | |
| SCHEMBL9238 | 0.85 | — | — | |
| SCHEMBL27937566 | 0.84 | ALDH1A1 (0.31) | — | |
| SCHEMBL11109727 | 0.83 | ALDH1A1 (0.31) | — | |
| SCHEMBL9432 | 0.83 | — | — |
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-108699380-B | Granulating stabilizer for multi-color pattern coating | 圣诺普科有限公司 | 2021-09-03 | — | — | CN | disclosed |