⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15047178 | 0.73 | — | — | |
| SCHEMBL29074835 | 0.73 | — | — | |
| SCHEMBL12987000 | 0.67 | — | — | |
| SCHEMBL12879727 | 0.67 | — | — | |
| SCHEMBL2914866 | 0.67 | — | — | |
| SCHEMBL16442461 | 0.65 | — | — | |
| SCHEMBL9430221 | 0.65 | — | — | |
| SCHEMBL6781767 | 0.64 | — | — | |
| SCHEMBL5522835 | 0.64 | — | — | |
| SCHEMBL1279693 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20070265446-A1 | Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists | CONNOLLY TERRENCE J | 2007-11-15 | — | — | US | disclosed |