⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7547382 | 0.83 | GPR119 (0.34) | — | |
| SCHEMBL5376623 | 0.79 | — | — | |
| SCHEMBL15980922 | 0.78 | — | — | |
| SCHEMBL15770 | 0.78 | — | — | |
| SCHEMBL16217683 | 0.73 | — | — | |
| SCHEMBL1904180 | 0.72 | CHRM5 (0.32) | — | |
| SCHEMBL3548485 | 0.71 | PTGS1 (0.33) | — | |
| SCHEMBL15707736 | 0.70 | — | — | |
| Bicarbonate SCHEMBL2015874 | 0.69 | TFPI2 (0.43) | — | |
| SCHEMBL4878851 | 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 |
|---|---|---|---|---|---|---|---|
| US-7232852-B2 | Photopolymerizable compositions that include alicyclic/aromatic dioxiranes and novel dioxiranyl tetraoxaspiro [5.5] undecanes | CURATORS OF THE UNIVERSITY OF MISSOURI (US) | 2007-06-19 | — | — | US | claimed |