⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4446616 | 1.00 | — | — | |
| SCHEMBL6847445 | 0.91 | TSHR (0.32) | — | |
| SCHEMBL3125065 | 0.89 | TSHR (0.31) | — | |
| SCHEMBL535074 | 0.89 | TSHR (0.31) | — | |
| SCHEMBL534357 | 0.89 | TSHR (0.31) | — | |
| SCHEMBL449783 | 0.89 | TSHR (0.31) | — | |
| SCHEMBL8601132 | 0.89 | TSHR (0.31) | — | |
| SCHEMBL18317983 | 0.84 | ALDH1A1 (0.30) | — | |
| SCHEMBL4449248 | 0.78 | TSHR (0.31) | — | |
| SCHEMBL535042 | 0.78 | TSHR (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2276781-B1 | ETHYLENE-TETRAFLUOROETHYLENE INTERMEDIATES | DU PONT (US) | 2012-11-07 | — | — | EP | disclosed |
| US-8212064-B2 | Ethylene tetrafluoroethylene intermediates | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-07-03 | — | — | US | disclosed |
| US-20090287010-A1 | Ethylene-tetrafluoroethylene intermediates | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2009-11-19 | — | — | US | disclosed |