⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL852992 | 0.79 | — | — | |
| SCHEMBL375674 | 0.79 | — | — | |
| SCHEMBL12680255 | 0.71 | ALDH1A1 (0.33) | — | |
| SCHEMBL15466503 | 0.67 | — | — | |
| SCHEMBL14791315 | 0.65 | ABAT (0.46) | — | |
| SCHEMBL1848855 | 0.65 | ABAT (0.46) | — | |
| SCHEMBL15466878 | 0.65 | ABAT (0.46) | — | |
| SCHEMBL698732 | 0.65 | ABAT (0.46) | — | |
| SCHEMBL4881136 | 0.63 | — | — | |
| SCHEMBL350173 | 0.62 | — | — |
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-20050267150-A1 | Cycloalkyl, lactam, lactone and related compounds, pharmaceutical compositions comprising same, and methods for inhibiting beta-amyloid peptide release and/or its synthesis by use of such compounds | THOMPSON RICHARD C | 2005-12-01 | — | — | US | disclosed |
| US-20050192265-A1 | Cycloalkyl, lactam, lactone and related compounds, pharmaceutical compositions comprising same, and methods for inhibiting beta-amyloid peptide release and/or its synthesis by use of such compounds | THOMPSON RICHARD C (US) | 2005-09-01 | — | — | US | disclosed |