⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22174721 | 0.87 | — | — | |
| SCHEMBL12333361 | 0.86 | ADH1B (0.38) | — | |
| SCHEMBL23875823 | 0.86 | ADH1B (0.38) | — | |
| SCHEMBL21693889 | 0.84 | — | — | |
| SCHEMBL15220287 | 0.80 | — | — | |
| SCHEMBL20632109 | 0.68 | — | — | |
| SCHEMBL25463543 | 0.67 | ADH1B (0.34) | — | |
| SCHEMBL23555441 | 0.67 | — | — | |
| SCHEMBL21997344 | 0.64 | ADH1B (1.00) | — | |
| SCHEMBL1678136 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3562487-B1 | METALLOENZYME INHIBITOR COMPOUNDS | JI XING PHARMACEUTICALS HONG KONG LTD (HK) | 2023-11-29 | — | — | EP | disclosed |
| WO-2018125800-A2 | METALLOENZYME INHIBITOR COMPOUNDS | VIAMET PHARMACEUTICALS (BERMUDA), LTD. (BM) | 2018-07-05 | — | — | WO | disclosed |
| US-20180186773-A1 | METALLOENZYME INHIBITOR COMPOUNDS | CORXEL PHARMACEUTICALS HONG KONG LIMITED (HK) | 2018-07-05 | — | — | US | disclosed |
| CN-101287711-A | Process for producing 1-substituted-5-acylimidazole compound | UBE INDUSTRIES (JP) | 2008-10-15 | — | — | CN | disclosed |