⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4598340 | 0.75 | — | — | |
| SCHEMBL20565668 | 0.74 | — | — | |
| SCHEMBL618264 | 0.73 | CA2 (0.32) | — | |
| SCHEMBL15559782 | 0.72 | CA2 (0.33) | — | |
| SCHEMBL8483032 | 0.70 | CA2 (0.35) | — | |
| SCHEMBL11409214 | 0.70 | — | — | |
| SCHEMBL6830961 | 0.70 | — | — | |
| SCHEMBL8483033 | 0.70 | CA2 (0.35) | — | |
| SCHEMBL11349386 | 0.69 | — | — | |
| SCHEMBL343428 | 0.69 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8969546-B2 | Compounds useful in imaging and therapy | THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) | 2015-03-03 | — | — | US | claimed |
| US-20130211066-A1 | COMPOUNDS USEFUL IN IMAGING AND THERAPY | ALBERTA HEALTH SERVICES (CA) | 2013-08-15 | — | — | US | claimed |
| WO-2011160216-A2 | COMPOUNDS USEFUL IN IMAGING AND THERAPY | THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) | 2011-12-29 | — | — | WO | claimed |
| US-8969546-B2 | Compounds useful in imaging and therapy | THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) | 2015-03-03 | — | — | US | disclosed |
| US-20130211066-A1 | COMPOUNDS USEFUL IN IMAGING AND THERAPY | ALBERTA HEALTH SERVICES (CA) | 2013-08-15 | — | — | US | disclosed |
| WO-2011160216-A2 | COMPOUNDS USEFUL IN IMAGING AND THERAPY | THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) | 2011-12-29 | — | — | WO | disclosed |
| EP-1091930-A1 | C-TERMINAL MODIFIED OXAMYL DIPEPTIDES AS INHIBITORS OF THE ICE/ced-3 FAMILY OF CYSTEINE PROTEASES | Idun Pharmaceuticals, Inc. (US) | 2001-04-18 | — | — | EP | disclosed |
| WO-2000001666-A1 | C-TERMINAL MODIFIED OXAMYL DIPEPTIDES AS INHIBITORS OF THE ICE/ced-3 FAMILY OF CYSTEINE PROTEASES | IDUN PHARMACEUTICALS, INC. (US) | 2000-01-13 | — | — | WO | disclosed |
| WO-1993010076-A1 | SYNTHESIS AND OPTICAL RESOLUTION OF THE TAXOL SIDE CHAIN AND RELATED COMPOUNDS | THE UNIVERSITY OF MISSISSIPPI (US) | 1993-05-27 | — | — | WO | disclosed |