⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10716418 | 0.87 | CYP1A2 (0.37) | — | |
| SCHEMBL28170843 | 0.79 | LMNA (0.42) | — | |
| SCHEMBL4365179 | 0.79 | LMNA (0.48) | — | |
| SCHEMBL2904704 | 0.79 | LMNA (0.48) | — | |
| SCHEMBL44490 | 0.79 | LMNA (0.48) | — | |
| SCHEMBL2904697 | 0.79 | LMNA (0.48) | — | |
| SCHEMBL2439178 | 0.78 | LMNA (0.44) | — | |
| SCHEMBL29355928 | 0.78 | LMNA (0.44) | — | |
| SCHEMBL1371812 | 0.78 | LMNA (0.41) | — | |
| SCHEMBL2905861 | 0.77 | — | — |
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-20040249098-A1 | (Meth)acrylic and (meth)acrylamide monomers comprising cyclic acetal/thioacetal groups, polymerizable compositions, and polymers obtained | THE REGENTS OF THE UNIVERSITY OF COLORADO | 2004-12-09 | — | — | US | disclosed |