⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20340973 | 0.78 | LMNA (0.40) | — | |
| SCHEMBL12336184 | 0.77 | — | — | |
| SCHEMBL16712830 | 0.74 | — | — | |
| SCHEMBL18697399 | 0.74 | ALDH1A1 (0.35) | — | |
| SCHEMBL806595 | 0.74 | — | — | |
| SCHEMBL12433049 | 0.72 | — | — | |
| SCHEMBL13189391 | 0.70 | ALDH1A1 (0.38) | — | |
| SCHEMBL13932204 | 0.70 | — | — | |
| SCHEMBL12607756 | 0.70 | — | — | |
| SCHEMBL9918141 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008104994-A2 | 2,2,2-TRI-SUBSTITUTED ACETAMIDE DERIVATIVES AS GLUCOKINASE ACTIVATORS, THEIR PROCESS AND PHARMACEUTICAL APPLICATION | ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) | 2008-09-04 | — | — | WO | disclosed |