⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13685272 | 1.00 | — | — | |
| SCHEMBL13685287 | 0.76 | APEX1 (0.32) | — | |
| SCHEMBL13685288 | 0.76 | APEX1 (0.32) | — | |
| SCHEMBL13685319 | 0.74 | PTGS1 (0.30) | — | |
| SCHEMBL13685320 | 0.74 | PTGS1 (0.30) | — | |
| SCHEMBL8726425 | 0.71 | PTGS1 (0.37) | — | |
| SCHEMBL8726421 | 0.71 | PTGS1 (0.37) | — | |
| SCHEMBL3623158 | 0.71 | TUBB1 (0.32) | — | |
| SCHEMBL13685089 | 0.71 | PTGS1 (0.32) | — | |
| SCHEMBL3231458 | 0.71 | PTGS1 (0.32) | — |
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 |