⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3063088 | 1.00 | — | — | |
| SCHEMBL23829876 | 1.00 | — | — | |
| SCHEMBL3063089 | 1.00 | — | — | |
| SCHEMBL2205577 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL3103866 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL3088998 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL3088996 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL3103859 | 0.97 | — | — | |
| Trifluoroacetic Acid SCHEMBL3312307 | 0.87 | GABRP (0.75) | — | |
| Trifluoroacetic Acid SCHEMBL21724533 | 0.87 | GABRP (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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004074431-A2 | PLANT ION CHANNELS AND RELATED METHODS | EMERALD BIOAGRICULTURE CORPORATION (US) | 2004-09-02 | — | — | WO | claimed |
| EP-1417315-A2 | PLANT ION CHANNELS AND METHODS | Emerald Bioagriculture Corporation (US) | 2004-05-12 | — | — | EP | claimed |
| EP-1158849-A4 | PLANT LIGAND-GATED ION CHANNELS | EMERALD BIOAGRICULTURE CORP (US) | 2003-07-30 | — | — | EP | claimed |
| WO-2003007886-A2 | PLANT ION CHANNELS AND METHODS | EMERALD BIOAGRICULTURE CORPORATION (US) | 2003-01-30 | — | — | WO | claimed |
| EP-1158849-A2 | PLANT LIGAND-GATED ION CHANNELS | Emerald Bioagriculture Corporation (US) | 2001-12-05 | — | — | EP | claimed |
| WO-2000052137-A2 | PLANT LIGAND-GATED ION CHANNELS | EMERALD BIOAGRICULTURE CORPORATION (US) | 2000-09-08 | — | — | WO | claimed |
| WO-2004074431-A2 | PLANT ION CHANNELS AND RELATED METHODS | EMERALD BIOAGRICULTURE CORPORATION (US) | 2004-09-02 | — | — | WO | disclosed |
| EP-1417315-A2 | PLANT ION CHANNELS AND METHODS | Emerald Bioagriculture Corporation (US) | 2004-05-12 | — | — | EP | disclosed |
| WO-2003007886-A2 | PLANT ION CHANNELS AND METHODS | EMERALD BIOAGRICULTURE CORPORATION (US) | 2003-01-30 | — | — | WO | disclosed |