⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1676731 | 0.79 | — | — | |
| SCHEMBL1676732 | 0.79 | — | — | |
| SCHEMBL11303827 | 0.77 | — | — | |
| SCHEMBL4323327 | 0.77 | PLA2G2C (0.44) | — | |
| SCHEMBL1649294 | 0.77 | PLA2G2C (0.44) | — | |
| SCHEMBL8208297 | 0.76 | ADH1B (0.48) | — | |
| SCHEMBL7211071 | 0.76 | ADH1B (0.48) | — | |
| SCHEMBL7291253 | 0.74 | CA1 (0.37) | — | |
| SCHEMBL9853666 | 0.73 | MAPT (0.38) | — | |
| SCHEMBL2182387 | 0.71 | DPP7 (0.57) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20030069447-A1 | Acetal hydroxylamine compounds | BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) | 2003-04-10 | — | — | US | disclosed |
| EP-1255727-A1 | ACETAL HYDROXYLAMINE COMPOUNDS | BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) | 2002-11-13 | — | — | EP | disclosed |
| WO-2001060785-A1 | ACETAL HYDROXYLAMINE COMPOUNDS | BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) | 2001-08-23 | — | — | WO | disclosed |