⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL19136624 | 0.97 | GMNN (0.40) | — | |
| Hydrochloric Acid SCHEMBL19136627 | 0.97 | GMNN (0.40) | — | |
| SCHEMBL575785 | 0.83 | — | — | |
| Lithium SCHEMBL31516949 | 0.79 | TSHR (0.32) | — | |
| Phosphine SCHEMBL21380520 | 0.79 | TSHR (0.32) | — | |
| SCHEMBL23073949 | 0.77 | — | — | |
| SCHEMBL19163866 | 0.77 | — | — | |
| SCHEMBL2161244 | 0.75 | — | — | |
| SCHEMBL19161066 | 0.75 | — | — | |
| SCHEMBL2625063 | 0.75 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109071484-A | Molecule with desinsection effectiveness, and intermediate relevant to these molecules, composition and method | 美国陶氏益农公司 | 2018-12-21 | — | — | CN | disclosed |
| WO-2017132014-A1 | MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2017-08-03 | — | — | WO | disclosed |
| US-20170210723-A1 | MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2017-07-27 | — | — | US | disclosed |
| US-20170210723-A1 | MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2017-07-27 | — | — | US | disclosed |