⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20860751 | 0.69 | — | — | |
| SCHEMBL14822863 | 0.69 | — | — | |
| SCHEMBL22180010 | 0.69 | — | — | |
| SCHEMBL12673220 | 0.69 | — | — | |
| SCHEMBL13981305 | 0.69 | — | — | |
| SCHEMBL4278728 | 0.64 | — | — | |
| SCHEMBL10742570 | 0.64 | — | — | |
| SCHEMBL17050366 | 0.64 | — | — | |
| SCHEMBL23365788 | 0.63 | — | — | |
| SCHEMBL17813791 | 0.63 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9497970-B2 | Pesticide compounds | BASF SE (DE) | 2016-11-22 | — | — | US | disclosed |
| US-20160157491-A1 | Pesticide Compounds | BASF SE (DE) | 2016-06-09 | — | — | US | disclosed |