⚠ 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 | |
|---|---|---|---|---|
| Methacrylic Acid SCHEMBL4179519 | 0.78 | TSHR (0.32) | — | |
| Methacrylic Acid SCHEMBL28754453 | 0.76 | TSHR (0.33) | — | |
| Methacrylic Acid SCHEMBL28089154 | 0.76 | ALDH1A1 (0.45) | — | |
| SCHEMBL1243374 | 0.75 | ALDH1A1 (0.41) | — | |
| SCHEMBL10387360 | 0.74 | TSHR (0.37) | — | |
| SCHEMBL6903864 | 0.71 | TSHR (0.36) | — | |
| SCHEMBL197921 | 0.69 | TSHR (0.34) | — | |
| Methacrylic Acid SCHEMBL11113770 | 0.68 | MEN1 (0.36) | — | |
| Methacrylic Acid SCHEMBL27851122 | 0.68 | ELANE (0.47) | — | |
| Methacrylic Acid SCHEMBL25425255 | 0.67 | TET2 (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101044146-A | Method for producing (trimethylsiloxy) silylalkylglycerol methacrylates | JOHNSON & JOHNSON VISION CARE (US) | 2007-09-26 | — | — | CN | disclosed |