⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31281224 | 0.76 | HSD11B1 (0.31) | — | |
| SCHEMBL2867612 | 0.74 | — | — | |
| SCHEMBL879175 | 0.70 | — | — | |
| SCHEMBL38665402 | 0.70 | — | — | |
| SCHEMBL8590212 | 0.68 | — | — | |
| SCHEMBL75605 | 0.68 | — | — | |
| SCHEMBL9681517 | 0.66 | — | — | |
| SCHEMBL15397651 | 0.65 | — | — | |
| SCHEMBL4921470 | 0.64 | — | — | |
| SCHEMBL17289492 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1183239-A1 | AROMATIC SULFONE HYDROXAMIC ACID METALLOPROTEASE INHIBITOR | G.D. SEARLE & CO. (US) | 2002-03-06 | — | — | EP | disclosed |
| WO-2000069821-A1 | AROMATIC SULFONE HYDROXAMIC ACID METALLOPROTEASE INHIBITOR | G.D. SEARLE & CO. (US) | 2000-11-23 | — | — | WO | disclosed |