⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19905801 | 0.71 | — | — | |
| SCHEMBL19905800 | 0.70 | — | — | |
| SCHEMBL12849082 | 0.69 | TRPA1 (0.40) | — | |
| SCHEMBL18801483 | 0.68 | — | — | |
| SCHEMBL13342645 | 0.67 | L3MBTL1 (0.37) | — | |
| SCHEMBL27809674 | 0.67 | — | — | |
| SCHEMBL27809675 | 0.63 | — | — | |
| SCHEMBL25028930 | 0.62 | — | — | |
| SCHEMBL5985135 | 0.62 | — | — | |
| SCHEMBL13812497 | 0.62 | — | — |
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-7371462-B2 | 1,3,5,7-tetramethylcyclotetrasiloxane and triallyl isocyanurate, a hydrosilylation catalyst, a silane coupling agent and/or an epoxy group-containing compound, and a silanol condensation catalyst | KANEKA CORPORATION (JP) | 2008-05-13 | — | — | US | disclosed |