⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7732054 | 0.69 | — | — | |
| SCHEMBL7732049 | 0.69 | — | — | |
| SCHEMBL487128 | 0.69 | — | — | |
| SCHEMBL23612 | 0.69 | — | — | |
| SCHEMBL23611 | 0.69 | — | — | |
| SCHEMBL7054552 | 0.67 | — | — | |
| SCHEMBL7365067 | 0.67 | — | — | |
| SCHEMBL7733946 | 0.67 | — | — | |
| SCHEMBL7733943 | 0.67 | — | — | |
| SCHEMBL7863874 | 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 |
|---|---|---|---|---|---|---|---|
| EP-1585826-B1 | ASSAY FOR INHIBITORS OF ISPH | BACHER ADELBERT (DE) | 2006-11-22 | — | — | EP | disclosed |
| EP-1585826-A2 | ASSAY FOR INHIBITORS OF ISPH | Bacher, Adelbert (DE) | 2005-10-19 | — | — | EP | disclosed |
| WO-2004065623-A3 | ASSAY FOR INHIBITORS OF ISPH | BACHER ADELBERT (DE) | 2004-09-30 | — | — | WO | disclosed |
| WO-2004065623-A2 | ASSAY FOR INHIBITORS OF ISPH | BACHER ADELBERT (DE) | 2004-08-05 | — | — | WO | disclosed |