⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6635427 | 1.00 | — | — | |
| SCHEMBL6633802 | 1.00 | — | — | |
| SCHEMBL6641169 | 0.92 | THRB (0.31) | — | |
| SCHEMBL6640180 | 0.92 | THRB (0.31) | — | |
| SCHEMBL29364985 | 0.88 | ALDH1A1 (0.30) | — | |
| SCHEMBL322925 | 0.84 | HTT (0.34) | — | |
| SCHEMBL1900469 | 0.84 | MAPK1 (0.34) | — | |
| SCHEMBL56208 | 0.84 | MAPK1 (0.34) | — | |
| SCHEMBL30951252 | 0.82 | — | — | |
| SCHEMBL18289500 | 0.81 | TSHR (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1086980-B1 | Use of polymer coating for rubber articles | NAT STARCH CHEM INVEST (US) | 2004-05-12 | — | — | EP | disclosed |
| EP-1086980-A1 | Use of polymer coating for rubber articles | National Starch and Chemical Investment Holding Corporation (US) | 2001-03-28 | — | — | EP | disclosed |