⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20511906 | 0.75 | — | — | |
| SCHEMBL4835265 | 0.73 | — | — | |
| SCHEMBL1110053 | 0.73 | — | — | |
| SCHEMBL4610496 | 0.73 | — | — | |
| SCHEMBL1110054 | 0.73 | — | — | |
| SCHEMBL253093 | 0.71 | — | — | |
| SCHEMBL1652643 | 0.71 | — | — | |
| SCHEMBL8026020 | 0.71 | — | — | |
| SCHEMBL5409455 | 0.71 | — | — | |
| SCHEMBL10711884 | 0.71 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104470589-B | Method for preparing fluoro betaine | 纳幕尔杜邦公司 | 2017-06-20 | — | — | CN | disclosed |
| WO-2008000682-A1 | FLUOROUS TELOMERIC COMPOUNDS AND POLYMERS CONTAINING SAME | CLARIANT INTERNATIONAL LTD (CH) | 2008-01-03 | — | — | WO | disclosed |
| EP-1095071-B1 | AROMATIC POLYMERS WITH PENDANT FLUORINATED IONIC GROUPS | DU PONT (US) | 2004-06-16 | — | — | EP | disclosed |
| US-4284746-A | Perfluoroalkyl-substituted amines as epoxy resin curing agents | DAIKIN KOGYO CO., LTD. (JP) | 1981-08-18 | — | — | US | disclosed |
| US-4080391-A | Process for the production of alcohols | MITSUI TOATSU CHEMICALS (JA) | 1978-03-21 | — | — | US | disclosed |