⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6901478 | 0.93 | — | — | |
| SCHEMBL17339054 | 0.93 | — | — | |
| SCHEMBL28547 | 0.93 | — | — | |
| SCHEMBL28403168 | 0.75 | THRB (0.36) | — | |
| SCHEMBL483389 | 0.73 | — | — | |
| SCHEMBL9114313 | 0.73 | — | — | |
| SCHEMBL891018 | 0.71 | — | — | |
| SCHEMBL27276486 | 0.69 | — | — | |
| SCHEMBL9912304 | 0.69 | LMNA (0.36) | — | |
| SCHEMBL2538689 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1678266-B1 | CLEANING AND MULTIFUNCTIONAL COATING COMPOSITION CONTAINING AN ORGANOSILANE QUATERNARY COMPOUND AND HYDROGEN PEROXIDE | RESOURCE DEV LLC (US) | 2008-01-23 | — | — | EP | disclosed |