⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6834812 | 0.70 | — | — | |
| SCHEMBL18198918 | 0.56 | — | — | |
| SCHEMBL9998880 | 0.53 | — | — | |
| SCHEMBL9734266 | 0.53 | — | — | |
| SCHEMBL2594729 | 0.52 | — | — | |
| SCHEMBL744298 | 0.51 | — | — | |
| SCHEMBL9998921 | 0.50 | — | — | |
| SCHEMBL21544446 | 0.50 | — | — | |
| SCHEMBL4883838 | 0.50 | — | — | |
| SCHEMBL12856856 | 0.49 | ALDH1A1 (0.67) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6268357-B1 | Organic vanadium (III) complexes and their use | THE UNIVERSITY OF BRITISH COLUMBIA (CA) | 2001-07-31 | — | — | US | claimed |
| WO-2000024730-A1 | ORGANIC VANADIUM(III) COMPLEXES AND THEIR USE | THE UNIVERSITY OF BRITISH COLUMBIA (CA) | 2000-05-04 | — | — | WO | claimed |
| US-6268357-B1 | Organic vanadium (III) complexes and their use | THE UNIVERSITY OF BRITISH COLUMBIA (CA) | 2001-07-31 | — | — | US | disclosed |
| WO-2000024730-A1 | ORGANIC VANADIUM(III) COMPLEXES AND THEIR USE | THE UNIVERSITY OF BRITISH COLUMBIA (CA) | 2000-05-04 | — | — | WO | disclosed |