⚠ 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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonic Acid SCHEMBL1451508 | 1.00 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL1451325 | 0.99 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL1451404 | 0.84 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL949646 | 0.83 | CA12 (0.31) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL31447267 | 0.82 | KCNH2 (0.33) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL3172629 | 0.79 | CA12 (0.30) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL3170682 | 0.79 | CA12 (0.30) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL1450800 | 0.78 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL4279876 | 0.77 | CA12 (0.33) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL3172625 | 0.77 | CA12 (0.33) | — |
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-6936672-B2 | Mold addition polymerization of norbornene-type monomers using group 10 metal complexes | SUMITOMO BAKELITE CO., LTD. (JP) | 2005-08-30 | — | — | US | claimed |