⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7272701 | 0.70 | — | — | |
| SCHEMBL5151082 | 0.69 | ALDH1A1 (0.48) | — | |
| SCHEMBL10949781 | 0.69 | — | — | |
| SCHEMBL3038699 | 0.67 | — | — | |
| SCHEMBL15406243 | 0.67 | — | — | |
| SCHEMBL9792614 | 0.67 | — | — | |
| SCHEMBL1288326 | 0.67 | — | — | |
| SCHEMBL27654964 | 0.67 | — | — | |
| SCHEMBL12787733 | 0.67 | — | — | |
| SCHEMBL4695529 | 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 |
|---|---|---|---|---|---|---|---|
| CN-1307472-A | Compositions for treating impotence comprising organo-nitrates or dinitrates | BAKER NORTON PHARMA (US) | 2001-08-08 | — | — | CN | claimed |
| EP-1079823-A1 | COMPOSITIONS COMPRISING ORGANIC MONO- OR DINITRATE FOR TREATING IMPOTENCE | BAKER NORTON PHARMACEUTICALS, INC. (US) | 2001-03-07 | — | — | EP | claimed |
| US-6056966-A | ORGANIC MONO- OR DINITRATE IN A PHARMACEUTICALLY ACCEPTABLE TOPICAL OR PARENTERAL CARRIER | BAKER NORTON PHARMACEUTICALS, INC. (US) | 2000-05-02 | — | — | US | claimed |
| WO-1999059575-A1 | COMPOSITIONS COMPRISING ORGANIC MONO- OR DINITRATE FOR TREATING IMPOTENCE | BAKER NORTON PHARMACEUTICALS, INC. (US) | 1999-11-25 | — | — | WO | claimed |