⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1032618 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL11593435 | 0.72 | — | — | |
| SCHEMBL23198645 | 0.72 | — | — | |
| SCHEMBL4447889 | 0.70 | — | — | |
| Trimethylammonium SCHEMBL27388609 | 0.70 | — | — | |
| Ethane SCHEMBL4370310 | 0.70 | — | — | |
| SCHEMBL3828689 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL10935098 | 0.69 | — | — | |
| SCHEMBL1032617 | 0.69 | — | — | |
| SCHEMBL644890 | 0.69 | — | — |
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-4450158-A | INSECTICIDES; NEMATOCIDES; LARVICIDES | FMC CORPORATION (US) | 1984-05-22 | — | — | US | disclosed |