⚠ 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 | |
|---|---|---|---|---|
| Potassium Ion SCHEMBL11705436 | 0.97 | — | — | |
| SCHEMBL11705448 | 0.97 | — | — | |
| Ammonia Solution, Strong SCHEMBL11700744 | 0.97 | — | — | |
| SCHEMBL8849680 | 0.85 | — | — | |
| SCHEMBL2159399 | 0.83 | CA1 (0.43) | — | |
| SCHEMBL11700424 | 0.83 | CA1 (0.33) | — | |
| Lithium Ion SCHEMBL11700416 | 0.83 | CA1 (0.33) | — | |
| SCHEMBL11808941 | 0.83 | CA1 (0.33) | — | |
| SCHEMBL11808956 | 0.83 | CA1 (0.33) | — | |
| Ammonia Solution, Strong SCHEMBL11701870 | 0.83 | CA1 (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114149409-B | (hetero) aryl amide compound with protein kinase inhibition activity | 中国药科大学 | 2024-03-22 | — | — | CN | disclosed |
| CN-114149409-A | (hetero) aryl amide compound with protein kinase inhibitory activity | 中国药科大学 | 2022-03-08 | — | — | CN | disclosed |