⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4789317 | 0.65 | — | — | |
| SCHEMBL6705787 | 0.62 | — | — | |
| SCHEMBL6705788 | 0.62 | ALDH1A1 (0.30) | — | |
| SCHEMBL23539431 | 0.56 | ALDH1A1 (0.31) | — | |
| SCHEMBL7038806 | 0.56 | CYP2C19 (0.34) | — | |
| SCHEMBL9003067 | 0.55 | — | — | |
| SCHEMBL29183124 | 0.55 | — | — | |
| SCHEMBL11765654 | 0.54 | CYP2C19 (0.36) | — | |
| Urea SCHEMBL3385100 | 0.53 | — | — | |
| SCHEMBL10689939 | 0.51 | ALDH1A1 (0.33) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7132449-B2 | Inhibitors of cruzipain and other cysteine proteases | AMURA THERAPEUTICS LIMITED (GB) | 2006-11-07 | — | — | US | claimed |
| US-20040127424-A1 | Inhibitors of cruzipain and other cysteine proteases | AMURA THERAPUTICS LIMITED (GB) | 2004-07-01 | — | — | US | claimed |
| EP-1358174-A2 | INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES | Amura Therapeutics Limited (GB) | 2003-11-05 | — | — | EP | claimed |
| WO-2002057248-A2 | INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES | AMURA THERAPEUTICS LIMITED (GB) | 2002-07-25 | — | — | WO | claimed |
| WO-2008134432-A1 | PROTEINASE INHIBITORS AND USES THEREOF | THE SCRIPPS RESEARCH INSTITUTE (US) | 2008-11-06 | — | — | WO | disclosed |
| WO-2008134429-A1 | CYSTEINE PROTEINASE INHIBITORS AND USES THEREOF | THE SCRIPPS RESEARCH INSTITUTE (US) | 2008-11-06 | — | — | WO | disclosed |
| US-7132449-B2 | Inhibitors of cruzipain and other cysteine proteases | AMURA THERAPEUTICS LIMITED (GB) | 2006-11-07 | — | — | US | disclosed |
| US-20040127424-A1 | Inhibitors of cruzipain and other cysteine proteases | AMURA THERAPUTICS LIMITED (GB) | 2004-07-01 | — | — | US | disclosed |
| EP-1358174-A2 | INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES | Amura Therapeutics Limited (GB) | 2003-11-05 | — | — | EP | disclosed |
| WO-2002057248-A2 | INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES | AMURA THERAPEUTICS LIMITED (GB) | 2002-07-25 | — | — | WO | disclosed |