⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6740181 | 0.74 | — | — | |
| SCHEMBL866696 | 0.72 | — | — | |
| SCHEMBL16149189 | 0.70 | CA12 (0.31) | — | |
| SCHEMBL5821998 | 0.70 | — | — | |
| SCHEMBL3298865 | 0.65 | ALDH1A1 (0.30) | — | |
| SCHEMBL8779875 | 0.64 | — | — | |
| SCHEMBL7455460 | 0.64 | — | — | |
| SCHEMBL3455316 | 0.64 | TP53 (0.33) | — | |
| SCHEMBL8561426 | 0.64 | — | — | |
| SCHEMBL30477999 | 0.61 | TSHR (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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6686313-B2 | REDUCING ORGANOSILVER COMPOUND | AGFA-GEVAERT (BE) | 2004-02-03 | — | — | US | claimed |
| US-20020111270-A1 | Thermographic recording material with improved image tone | AGFA-GEVAERT (BE) | 2002-08-15 | — | — | US | claimed |
| EP-1211091-A1 | Thermographic recording material with improved image tone | Agfa-Gevaert (BE) | 2002-06-05 | — | — | EP | claimed |
| US-6686313-B2 | REDUCING ORGANOSILVER COMPOUND | AGFA-GEVAERT (BE) | 2004-02-03 | — | — | US | disclosed |
| US-20020111270-A1 | Thermographic recording material with improved image tone | AGFA-GEVAERT (BE) | 2002-08-15 | — | — | US | disclosed |
| EP-1211091-A1 | Thermographic recording material with improved image tone | Agfa-Gevaert (BE) | 2002-06-05 | — | — | EP | disclosed |