⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14960539 | 0.89 | — | — | |
| SCHEMBL17029364 | 0.83 | — | — | |
| SCHEMBL18675345 | 0.74 | — | — | |
| SCHEMBL17972796 | 0.66 | — | — | |
| SCHEMBL17366434 | 0.60 | — | — | |
| SCHEMBL17366427 | 0.59 | — | — | |
| SCHEMBL180350 | 0.59 | TSHR (0.42) | — | |
| SCHEMBL18994842 | 0.55 | — | — | |
| SCHEMBL11996153 | 0.55 | — | — | |
| SCHEMBL14076169 | 0.54 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9115138-B2 | Porphyrin compounds comprising one or more pyridone moieties | VENTANA RESEARCH CORPORATION | 2015-08-25 | — | — | US | disclosed |
| US-8445683-B2 | Porphyrin compounds comprising one or more pyridone moieties | VENTANA RESEARCH CORPORATION | 2013-05-21 | — | — | US | disclosed |