⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9290920 | 0.79 | — | — | |
| SCHEMBL9290772 | 0.78 | — | — | |
| SCHEMBL9290751 | 0.74 | — | — | |
| SCHEMBL9505880 | 0.67 | APOBEC3A (0.39) | — | |
| SCHEMBL9290853 | 0.64 | NOS3 (0.41) | — | |
| Sulfuric Acid SCHEMBL9290874 | 0.61 | RAD52 (0.40) | — | |
| SCHEMBL1679702 | 0.57 | HSD17B10 (0.38) | — | |
| SCHEMBL9290740 | 0.54 | — | — | |
| SCHEMBL22750796 | 0.52 | — | — | |
| Trolamine SCHEMBL4599394 | 0.50 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5356895-A | Aminoguanidine derivatives; preventing food spoilage, animal aging | THE ROCKEFELLER UNIVERSITY (US) | 1994-10-18 | — | — | US | disclosed |
| EP-0327919-B1 | METHOD AND AGENTS FOR PREVENTING STAINING OF TEETH | THE ROCKEFELLER UNIVERSITY (US) | 1993-09-15 | — | — | EP | disclosed |
| US-5140048-A | Inhibitors of nonenzymatic cross-linking | THE ROCKEFELLER UNIVERSITY (US) | 1992-08-18 | — | — | US | disclosed |
| US-5128122-A | Nitrogen compound | THE ROCKEFELLER UNIVERSITY (US) | 1992-07-07 | — | — | US | disclosed |
| US-4983604-A | Aminoguanidine derivatives | THE ROCKEFELLER UNIVERSITY (US) | 1991-01-08 | — | — | US | disclosed |
| US-4908446-A | Inhibitors of nonenzymatic cross-linking | THE ROCKEFELLER UNIVERSITY (US) | 1990-03-13 | — | — | US | disclosed |
| EP-0316852-A2 | Inhibitors of nonenzymatic cross-linking | THE ROCKEFELLER UNIVERSITY (US) | 1989-05-24 | — | — | EP | disclosed |