⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8450314 | 0.59 | — | — | |
| SCHEMBL18261219 | 0.43 | — | — | |
| Butane SCHEMBL7744469 | 0.41 | LMNA (0.31) | — | |
| SCHEMBL11330344 | 0.39 | — | — | |
| Propane SCHEMBL2281997 | 0.38 | — | — | |
| SCHEMBL28520803 | 0.38 | — | — | |
| SCHEMBL22977587 | 0.37 | — | — | |
| Propane SCHEMBL9645526 | 0.35 | — | — | |
| Butane SCHEMBL1872873 | 0.35 | — | — | |
| Propane SCHEMBL10594073 | 0.35 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0348343-A2 | Synergistic agent and process for selective weed control in cereals, maize and rice | CIBA-GEIGY AG (CH) | 1989-12-27 | — | — | EP | claimed |
| EP-0348343-A2 | Synergistic agent and process for selective weed control in cereals, maize and rice | CIBA-GEIGY AG (CH) | 1989-12-27 | — | — | EP | disclosed |