⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL666240 | 0.79 | KMT2A (0.40) | — | |
| SCHEMBL9450602 | 0.79 | KMT2A (0.40) | — | |
| SCHEMBL21182216 | 0.79 | KMT2A (0.40) | — | |
| SCHEMBL14393118 | 0.79 | KMT2A (0.40) | — | |
| SCHEMBL666242 | 0.79 | KMT2A (0.40) | — | |
| SCHEMBL12675967 | 0.79 | KMT2A (0.40) | — | |
| SCHEMBL13013601 | 0.72 | — | — | |
| SCHEMBL12859007 | 0.66 | ALDH1A1 (0.35) | — | |
| SCHEMBL13016679 | 0.66 | ALDH1A1 (0.35) | — | |
| SCHEMBL12675743 | 0.66 | ALDH1A1 (0.35) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2258790-B1 | COMPOSITIONS COMPRISING A FLUOROOLEFIN | CHEMOURS CO FC LLC (US) | 2017-01-11 | — | — | EP | disclosed |
| EP-2258801-A2 | Compositions comprising a fluoroolefin | E. I. du Pont de Nemours and Company (US) | 2010-12-08 | — | — | EP | disclosed |