⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL875914 | 0.97 | — | — | |
| SCHEMBL28218413 | 0.94 | — | — | |
| SCHEMBL28938398 | 0.94 | — | — | |
| SCHEMBL5902580 | 0.94 | — | — | |
| SCHEMBL27857721 | 0.94 | — | — | |
| SCHEMBL8402831 | 0.92 | ALDH1A1 (0.40) | — | |
| SCHEMBL350570 | 0.77 | — | — | |
| SCHEMBL1563009 | 0.75 | — | — | |
| SCHEMBL8334187 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL7477519 | 0.74 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117003773-A | Preparation and application of copper urease acetate complex | 合肥工业大学 | 2023-11-07 | — | — | CN | claimed |
| CN-117003773-A | Preparation and application of copper urease acetate complex | 合肥工业大学 | 2023-11-07 | — | — | CN | disclosed |
| CN-117003773-A | Preparation and application of copper urease acetate complex | 合肥工业大学 | 2023-11-07 | — | — | CN | disclosed |