⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2339592 | 0.86 | — | — | |
| SCHEMBL2339588 | 0.86 | — | — | |
| SCHEMBL1690427 | 0.86 | — | — | |
| SCHEMBL1690426 | 0.86 | — | — | |
| SCHEMBL2437014 | 0.84 | — | — | |
| SCHEMBL2437015 | 0.84 | — | — | |
| SCHEMBL2058503 | 0.84 | THRB (0.36) | — | |
| SCHEMBL2058504 | 0.84 | THRB (0.36) | — | |
| SCHEMBL1690465 | 0.83 | — | — | |
| SCHEMBL1690467 | 0.83 | — | — |
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-8012368-B2 | Compositions comprising fluoroolefins and uses thereof | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2011-09-06 | — | — | US | disclosed |