⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1758887 | 0.83 | — | — | |
| SCHEMBL3039644 | 0.79 | — | — | |
| SCHEMBL899456 | 0.75 | — | — | |
| SCHEMBL4712021 | 0.74 | — | — | |
| SCHEMBL1454269 | 0.73 | — | — | |
| SCHEMBL2052417 | 0.72 | — | — | |
| SCHEMBL2136680 | 0.72 | — | — | |
| SCHEMBL2136686 | 0.72 | — | — | |
| SCHEMBL5985912 | 0.71 | — | — | |
| SCHEMBL5985909 | 0.71 | — | — |
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-6506800-B2 | For control of insect and acarid pests | BASF AKTIENGESELLSCHAFT (DE) | 2003-01-14 | — | — | US | disclosed |
| US-5602074-A | HERBICIDES; PLANT DESICCATION, DEFOLIATION | BASF AKTIENGESELLSCHAFT (DE) | 1997-02-11 | — | — | US | disclosed |