⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23865152 | 0.80 | LMNA (0.43) | — | |
| SCHEMBL475146 | 0.74 | LMNA (0.35) | — | |
| SCHEMBL1704473 | 0.73 | — | — | |
| SCHEMBL21648830 | 0.73 | — | — | |
| SCHEMBL25128864 | 0.71 | — | — | |
| SCHEMBL24238219 | 0.69 | — | — | |
| SCHEMBL19958496 | 0.69 | — | — | |
| SCHEMBL3167161 | 0.69 | GAA (0.34) | — | |
| SCHEMBL14086382 | 0.67 | GAA (0.31) | — | |
| SCHEMBL21599306 | 0.67 | TSHR (0.50) | — |
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-20150238948-A1 | POLYMERIC AND SOLID-SUPPORTED CATALYSTS, AND METHODS OF DIGESTING LIGNIN-CONTAINING MATERIALS USING SUCH CATALYSTS | Midori Renewables, Inc. (US) | 2015-08-27 | — | — | US | disclosed |