⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1290817 | 0.80 | — | — | |
| SCHEMBL1290815 | 0.73 | — | — | |
| SCHEMBL2070287 | 0.67 | — | — | |
| SCHEMBL29123590 | 0.66 | — | — | |
| SCHEMBL4941897 | 0.66 | — | — | |
| SCHEMBL28984291 | 0.65 | CYP3A4 (0.31) | — | |
| SCHEMBL9752646 | 0.63 | TRPV1 (0.30) | — | |
| SCHEMBL536033 | 0.62 | — | — | |
| SCHEMBL5839507 | 0.62 | CA1 (0.31) | — | |
| SCHEMBL16431451 | 0.61 | FDPS (0.31) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8512934-B2 | Sulphonium salt initiators | BASF SE (DE) | 2013-08-20 | — | — | US | disclosed |
| US-7901867-B2 | Sulphonium salt initiators | BASF SE (DE) | 2011-03-08 | — | — | US | disclosed |
| US-20100297542-A1 | SULPHONIUM SALT INITIATORS | BASF SE (DE) | 2010-11-25 | — | — | US | disclosed |
| EP-2194083-A1 | Additive for primer compositions | Dow Global Technologies Inc. (US) | 2010-06-09 | — | — | EP | disclosed |
| US-20090208872-A1 | Sulphonium Salt Initiators | BASF SE (DE) | 2009-08-20 | — | — | US | disclosed |