⚠ 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 SCHEMBL264345 | 0.96 | — | — | |
| Methacrylic Acid SCHEMBL27733121 | 0.96 | — | — | |
| Methacrylic Acid SCHEMBL8503459 | 0.96 | TDP1 (0.50) | — | |
| Methacrylic Acid SCHEMBL28384964 | 0.96 | — | — | |
| Methacrylic Acid SCHEMBL331576 | 0.96 | — | — | |
| Methacrylic Acid SCHEMBL25392450 | 0.92 | — | — | |
| Methacrylic Acid SCHEMBL28081983 | 0.92 | TDP1 (0.47) | — | |
| Methacrylic Acid SCHEMBL9551666 | 0.92 | — | — | |
| Methacrylic Acid SCHEMBL28476049 | 0.92 | — | — | |
| Methacrylic Acid SCHEMBL27835871 | 0.92 | — | — |
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-101723823-A | Gemfibrozil composite method | SHANGHAI ECUST BIOMEDICINE CO | 2010-06-09 | — | — | CN | disclosed |