⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22825041 | 0.82 | — | — | |
| SCHEMBL14498523 | 0.70 | — | — | |
| SCHEMBL16596781 | 0.70 | — | — | |
| SCHEMBL17278948 | 0.70 | — | — | |
| SCHEMBL25328206 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL28595304 | 0.67 | — | — | |
| SCHEMBL16408971 | 0.67 | — | — | |
| SCHEMBL14391434 | 0.67 | — | — | |
| SCHEMBL19049 | 0.65 | — | — | |
| SCHEMBL16144920 | 0.65 | — | — |
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-2638002-B1 | METHOD FOR PREPARING 2,2-DIFLUOROETHYLAMINE STARTING FROM A BENZYLAMINE COMPOUND | BAYER IP GMBH (DE) | 2017-05-10 | — | — | EP | disclosed |
| EP-2638002-A1 | METHOD FOR PREPARING 2,2-DIFLUOROETHYLAMINE STARTING FROM A BENZYLAMINE COMPOUND | Bayer Intellectual Property GmbH (DE) | 2013-09-18 | — | — | EP | disclosed |
| WO-2012062702-A1 | METHOD FOR PREPARING 2,2-DIFLUOROETHYLAMINE STARTING FROM A BENZYLAMINE COMPOUND | BAYER CROPSCIENCE AG (DE) | 2012-05-18 | — | — | WO | disclosed |