⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6836742 | 0.89 | — | — | |
| SCHEMBL6838755 | 0.83 | — | — | |
| SCHEMBL26229944 | 0.74 | ALDH1A1 (0.30) | — | |
| SCHEMBL7913290 | 0.73 | TSHR (0.31) | — | |
| SCHEMBL27074500 | 0.71 | HPGD (0.31) | — | |
| SCHEMBL7919981 | 0.68 | — | — | |
| SCHEMBL19881178 | 0.67 | HSD11B1 (0.31) | — | |
| SCHEMBL825348 | 0.67 | HSD11B1 (0.31) | — | |
| SCHEMBL7921661 | 0.67 | — | — | |
| SCHEMBL7198671 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110891981-B | Radiation curable coating composition for improving surface properties of plastics | 阿科玛法国公司 | 2022-03-29 | — | — | CN | disclosed |
| WO-2006045400-A1 | COATED PLASTIC SHAPED BODY | RÖHM GMBH (DE) | 2006-05-04 | — | — | WO | disclosed |