⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1099881 | 0.82 | F3 (0.34) | — | |
| SCHEMBL3131678 | 0.79 | GABRP (0.46) | — | |
| SCHEMBL3131666 | 0.79 | GABRP (0.46) | — | |
| SCHEMBL2357069 | 0.79 | GABRP (0.46) | — | |
| SCHEMBL2357063 | 0.79 | GABRP (0.46) | — | |
| SCHEMBL43207 | 0.78 | — | — | |
| SCHEMBL103982 | 0.78 | — | — | |
| SCHEMBL12714083 | 0.78 | — | — | |
| SCHEMBL28412197 | 0.78 | HCAR2 (0.36) | — | |
| SCHEMBL13685293 | 0.78 | GABRP (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 |
|---|---|---|---|---|---|---|---|
| EP-1776399-B1 | MONODISPERSE POLYMERS CONTAINING (ALKYL)ACRYLIC ACID MOIETIES, PRECURSORS AND METHODS FOR MAKING THEM AND THEIR APPLICATIONS | UNIV GENT (BE) | 2012-11-14 | — | — | EP | claimed |