⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6661933 | 1.00 | — | — | |
| SCHEMBL13973671 | 1.00 | — | — | |
| SCHEMBL8026438 | 0.82 | HCAR2 (0.41) | — | |
| SCHEMBL12789347 | 0.80 | — | — | |
| SCHEMBL6274170 | 0.80 | — | — | |
| SCHEMBL111293 | 0.80 | — | — | |
| SCHEMBL111294 | 0.80 | — | — | |
| SCHEMBL6274167 | 0.80 | — | — | |
| SCHEMBL9650363 | 0.79 | — | — | |
| Ammonia Solution, Strong SCHEMBL16781360 | 0.78 | GLO1 (0.52) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113288817-A | Dental material based on a cyclizable, polymerizable cross-linking agent | 义获嘉伟瓦登特公司 | 2021-08-24 | — | — | CN | disclosed |
| US-20040224951-A1 | 5,6-Fused uracil derivatives as matrix metalloproteinase inhibitors | ROARK WILLIAM HOWARD (US) | 2004-11-11 | — | — | US | disclosed |
| US-20040063673-A1 | Cyclic compounds containing zinc binding groups as matrix metalloproteinase inhibitors | JOHNSON ADAM RICHARD (US) | 2004-04-01 | — | — | US | disclosed |
| WO-2004014384-A2 | CYCLIC COMPOUNDS CONTAINING ZINC BINDING GROUPS AS MATRIX METALLOPROTEINASE INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2004-02-19 | — | — | WO | disclosed |
| WO-2004014921-A1 | 5,6-FUSED URACIL DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2004-02-19 | — | — | WO | disclosed |