⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6905181 | 0.88 | — | — | |
| SCHEMBL6904041 | 0.87 | — | — | |
| SCHEMBL6907143 | 0.87 | — | — | |
| SCHEMBL2864141 | 0.87 | — | — | |
| SCHEMBL5080270 | 0.85 | — | — | |
| SCHEMBL6903084 | 0.84 | — | — | |
| SCHEMBL6904394 | 0.84 | — | — | |
| SCHEMBL17698564 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL454888 | 0.82 | — | — | |
| SCHEMBL6906616 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6831104-B2 | Comprises nonlethal knockout agent (trans-dichloroethylene) and an insecticide for treating earthen colonies | TAYLOR TOMMY G (US) | 2004-12-14 | — | — | US | disclosed |