⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5586699 | 1.00 | — | — | |
| SCHEMBL16859987 | 0.92 | — | — | |
| SCHEMBL16859993 | 0.90 | TSHR (0.52) | — | |
| SCHEMBL16859969 | 0.90 | TSHR (0.52) | — | |
| SCHEMBL16860002 | 0.90 | TSHR (0.52) | — | |
| SCHEMBL16859999 | 0.90 | TSHR (0.52) | — | |
| SCHEMBL16859973 | 0.90 | TSHR (0.52) | — | |
| SCHEMBL16859980 | 0.90 | TSHR (0.52) | — | |
| SCHEMBL16859968 | 0.90 | TSHR (0.52) | — | |
| SCHEMBL16859981 | 0.90 | TSHR (0.52) | — |
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-3089584-A1 | AGRICULTURAL PESTICIDE COMPOSITIONS | Rhodia Operations (FR) | 2016-11-09 | — | — | EP | disclosed |
| WO-2015103192-A1 | AGRICULTURAL PESTICIDE COMPOSITIONS | RHODIA OPERATIONS (FR) | 2015-07-09 | — | — | WO | disclosed |
| US-20150181862-A1 | AGRICULTURAL PESTICIDE COMPOSITIONS | RHODIA OPERATIONS (FR) | 2015-07-02 | — | — | US | disclosed |