⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL184021 | 0.76 | TET2 (0.34) | — | |
| Itaconate SCHEMBL28335087 | 0.73 | ALOX15 (0.58) | — | |
| SCHEMBL5484859 | 0.73 | TBXAS1 (0.33) | — | |
| SCHEMBL9439672 | 0.73 | — | — | |
| SCHEMBL9641013 | 0.73 | — | — | |
| SCHEMBL2177849 | 0.73 | — | — | |
| SCHEMBL9640216 | 0.73 | — | — | |
| SCHEMBL8153060 | 0.69 | TDP1 (0.32) | — | |
| SCHEMBL14351657 | 0.67 | — | — | |
| SCHEMBL4442753 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1427763-A1 | METHOD FOR THE PRODUCTION OF POLYMERS AND COPOLYMERS FROM ACRYLIC COMPOUNDS | Röhm GmbH & Co. KG (DE) | 2004-06-16 | — | — | EP | disclosed |
| WO-2003048176-A1 | CATALYST FOR PRODUCING (CO)POLYMERS OF (METH)ACRYLIC COMPOUNDS | Röhm GmbH & Co. KG (DE) | 2003-06-12 | — | — | WO | disclosed |
| WO-2003022897-A1 | METHOD FOR THE PRODUCTION OF POLYMERS AND COPOLYMERS FROM ACRYLIC COMPOUNDS | Röhm GmbH & Co. KG (DE) | 2003-03-20 | — | — | WO | disclosed |