⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2491827 | 0.81 | — | — | |
| SCHEMBL7294172 | 0.75 | ALDH1A1 (0.39) | — | |
| SCHEMBL8464996 | 0.73 | — | — | |
| Formaldehyde SCHEMBL27797381 | 0.70 | — | — | |
| Ethylene SCHEMBL2492247 | 0.70 | — | — | |
| SCHEMBL4971363 | 0.69 | — | — | |
| SCHEMBL20796 | 0.69 | — | — | |
| SCHEMBL4748477 | 0.69 | ALDH1A1 (0.54) | — | |
| SCHEMBL214908 | 0.69 | — | — | |
| SCHEMBL22044442 | 0.69 | — | — |
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-1029613-C | Oxime-carbamates and oxime-carbonates as bronchodilators and anti-inflamatory agents | AMERICAN HOME PROD (US) | 1995-08-30 | — | — | CN | disclosed |
| CN-1058771-A | Method for making of oxime carbamate and oxime carbonate ester and uses thereof | AMERICAN HOME PROD (US) | 1992-02-19 | — | — | CN | disclosed |