⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1700780 | 0.80 | DGAT1 (0.36) | — | |
| SCHEMBL11275237 | 0.75 | F2 (0.31) | — | |
| SCHEMBL28705875 | 0.74 | THRB (0.31) | — | |
| SCHEMBL9569891 | 0.74 | — | — | |
| SCHEMBL4383211 | 0.72 | THRB (0.40) | — | |
| SCHEMBL4381868 | 0.72 | — | — | |
| SCHEMBL10634212 | 0.71 | HTT (0.43) | — | |
| Water SCHEMBL11295291 | 0.71 | TSHR (0.36) | — | |
| SCHEMBL10340782 | 0.70 | — | — | |
| SCHEMBL31582477 | 0.70 | CES2 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170198070-A1 | AQUEOUS POLYMERIZATION OF FLUORINATED MONOMER USING POLYMERIZATION AGENT COMPRISING FLUOROPOLYETHER ACID OR SALT AND SHORT CHAIN FLUOROSURFACTANT | THE CHEMOURS COMPANY FC, LLC | 2017-07-13 | — | — | US | disclosed |