⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3320964 | 0.80 | — | — | |
| SCHEMBL5551199 | 0.69 | — | — | |
| SCHEMBL2088240 | 0.69 | — | — | |
| SCHEMBL3322648 | 0.67 | — | — | |
| SCHEMBL1454622 | 0.67 | — | — | |
| SCHEMBL11286632 | 0.67 | — | — | |
| SCHEMBL37658 | 0.65 | — | — | |
| SCHEMBL7286248 | 0.65 | — | — | |
| SCHEMBL7863326 | 0.65 | — | — | |
| SCHEMBL6676785 | 0.65 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1157694-A1 | REMEDIAL AGENT FOR ERECTILE DYSFUNCTION | Nissan Chemical Industries, Ltd. (JP) | 2001-11-28 | — | — | EP | disclosed |