⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13232013 | 0.91 | — | — | |
| SCHEMBL824378 | 0.89 | HTT (0.32) | — | |
| SCHEMBL15214094 | 0.89 | DGKA (0.30) | — | |
| SCHEMBL824295 | 0.88 | — | — | |
| SCHEMBL13146696 | 0.83 | — | — | |
| SCHEMBL13232010 | 0.80 | MAPT (0.31) | — | |
| SCHEMBL824329 | 0.80 | HTT (0.31) | — | |
| SCHEMBL15214096 | 0.80 | — | — | |
| SCHEMBL13153222 | 0.79 | — | — | |
| SCHEMBL24832401 | 0.77 | CYP4F2 (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8324331-B2 | Fluorine-containing compound and polymeric compound | DAITO CHEMIX CORPORATION (JP) | 2012-12-04 | — | — | US | disclosed |
| US-20100168358-A1 | FLUORINE-CONTAINING COMPOUND AND POLYMERIC COMPOUND | DAITO CHEMIX CORPORATION (JP) | 2010-07-01 | — | — | US | disclosed |