⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18358233 | 0.79 | — | — | |
| SCHEMBL28573529 | 0.79 | — | — | |
| SCHEMBL28574958 | 0.79 | — | — | |
| SCHEMBL965530 | 0.76 | — | — | |
| SCHEMBL21114488 | 0.76 | — | — | |
| SCHEMBL29557438 | 0.76 | — | — | |
| SCHEMBL7169460 | 0.76 | — | — | |
| SCHEMBL28473335 | 0.74 | — | — | |
| SCHEMBL1187300 | 0.72 | — | — | |
| SCHEMBL28394231 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1038916-A | Composition pesticide | DU PONT (US) | 1990-01-24 | — | — | CN | disclosed |