⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9966327 | 0.76 | ALDH1A1 (0.44) | — | |
| SCHEMBL22037294 | 0.76 | ALDH1A1 (0.44) | — | |
| SCHEMBL12957660 | 0.76 | ALDH1A1 (0.50) | — | |
| SCHEMBL19277855 | 0.74 | — | — | |
| SCHEMBL19277552 | 0.74 | — | — | |
| SCHEMBL21741891 | 0.74 | — | — | |
| SCHEMBL393241 | 0.70 | GBA1 (0.31) | — | |
| SCHEMBL1613729 | 0.70 | GBA1 (0.31) | — | |
| SCHEMBL19736584 | 0.69 | ALDH1A1 (0.44) | — | |
| SCHEMBL18883251 | 0.67 | ALDH1A1 (0.46) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8298657-B2 | Porous interpenetrating polymer network | ALEX G. BONNER DBA BIOLINK PARTNERS | 2012-10-30 | — | — | US | disclosed |
| EP-2398577-A2 | POROUS INTERPENETRATING POLYMER NETWORK | Bonner, Alex Garfield (US) | 2011-12-28 | — | — | EP | disclosed |
| WO-2010096704-A2 | POROUS INTERPENETRATING POLYMER NETWORK | BONNER ALEX GARFIELD (US) | 2010-08-26 | — | — | WO | disclosed |