⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8108009 | 0.87 | — | — | |
| Methacrylic Acid SCHEMBL14994193 | 0.76 | — | — | |
| SCHEMBL5365264 | 0.72 | THRB (0.41) | — | |
| Methacrylic Acid SCHEMBL10482702 | 0.71 | THRB (0.31) | — | |
| Methacrylic Acid SCHEMBL43871 | 0.71 | THRB (0.32) | — | |
| Methacrylic Acid SCHEMBL43930 | 0.70 | THRB (0.31) | — | |
| Methacrylic Acid SCHEMBL9222629 | 0.68 | TSHR (0.33) | — | |
| SCHEMBL794533 | 0.68 | — | — | |
| Methacrylic Acid SCHEMBL27766190 | 0.68 | TGFBR1 (0.31) | — | |
| Methacrylic Acid SCHEMBL22325631 | 0.67 | TGFBR1 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4351922-A | ADDITION-CONDENSATION POLYMERS FROM UNSATURATED CARBOXY ACIDS, SULFONIC ACIDS, AMIDES, OR NITRILES AND GLYCIDOL-MODIFIED POLYOXYETHYLENE GLYCOL | SHOWA DENKO KABUSHIKI KAISHA (JP) | 1982-09-28 | — | — | US | disclosed |