⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1324800 | 0.35 | ALDH1A1 (0.42) | — | |
| SCHEMBL29846477 | 0.35 | CDC25B (0.30) | — | |
| SCHEMBL30574445 | 0.35 | CDC25B (0.30) | — | |
| Ammonia Solution, Strong SCHEMBL27782930 | 0.30 | — | — | |
| SCHEMBL11178675 | 0.29 | — | — | |
| Ammonia Solution, Strong SCHEMBL9499458 | 0.29 | — | — | |
| Fluoride SCHEMBL29110940 | 0.25 | — | — | |
| Ammonia Solution, Strong SCHEMBL28755775 | 0.25 | — | — | |
| SCHEMBL94092 | 0.25 | — | — | |
| SCHEMBL3000562 | 0.25 | — | — |
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-109749615-A | Iron particle passivation | 波音公司 | 2019-05-14 | — | — | CN | disclosed |