⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9035654 | 0.80 | SLC2A1 (0.31) | — | |
| SCHEMBL9036382 | 0.77 | — | — | |
| SCHEMBL13934684 | 0.74 | GBA1 (0.30) | — | |
| SCHEMBL9036016 | 0.70 | — | — | |
| SCHEMBL9035649 | 0.69 | — | — | |
| SCHEMBL9035251 | 0.66 | — | — | |
| SCHEMBL5204105 | 0.66 | CYP19A1 (0.33) | — | |
| Oxirane SCHEMBL22392163 | 0.64 | ALDH1A1 (0.46) | — | |
| SCHEMBL9035514 | 0.64 | — | — | |
| SCHEMBL23114589 | 0.63 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050065161-A1 | Nitrosated and nitrosylated alpha-adrenergic receptor antagonist compounds, compositions and their uses | NITROMED, INC. (US) | 2005-03-24 | — | — | US | disclosed |
| US-6514934-B1 | For treating sexual dysfunctions in males and females | NITROMED, INC. | 2003-02-04 | — | — | US | disclosed |
| US-6433182-B1 | MUSCLE RELAXANTS; THERAPY FOR SEXUAL DISORDERS | NITROMED, INC. | 2002-08-13 | — | — | US | disclosed |
| EP-1018879-A4 | NITROSATED AND NITROSYLATED ALPHA-ADRENERGIC RECEPTOR ANTAGONIST COMPOUNDS, COMPOSITIONS AND THEIR USES | NITROMED INC (US) | 2002-07-24 | — | — | EP | disclosed |
| US-6417162-B1 | FEMALE IMPOTENCE TREATED WITH HETEROCYCLIC COMPOUND CONTAINING NITRO GROUPS | NITROMED, INC. | 2002-07-09 | — | — | US | disclosed |
| US-20020061879-A1 | Nitrosated and nitrosylated alpha-adrenergic receptor antagonist compounds, compositions and their uses | GARVEY DAVID S (US) | 2002-05-23 | — | — | US | disclosed |
| US-6294517-B1 | ALKALOIDS AND COMPOUNDS THAT RELEASE NITRIC OXIDE FOR TREATMENT OF IMPOTENCE | NITROMED, INC. | 2001-09-25 | — | — | US | disclosed |
| EP-1018879-A1 | NITROSATED AND NITROSYLATED ALPHA-ADRENERGIC RECEPTOR ANTAGONIST COMPOUNDS, COMPOSITIONS AND THEIR USES | Nitromed, Inc. (US) | 2000-07-19 | — | — | EP | disclosed |
| US-5994294-A | Nitrosated and nitrosylated α-adrenergic receptor antagonist compounds, compositions and their uses | NITROMED, INC. (US) | 1999-11-30 | — | — | US | disclosed |
| WO-1997027749-A1 | NITROSATED AND NITROSYLATED α-ADRENERGIC RECEPTOR ANTAGONIST COMPOUNDS, COMPOSITIONS AND THEIR USES | NITROMED, INC. (US) | 1997-08-07 | — | — | WO | disclosed |