⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6980770 | 0.71 | — | — | |
| SCHEMBL24419255 | 0.68 | ESR1 (0.31) | — | |
| SCHEMBL5802856 | 0.68 | — | — | |
| SCHEMBL6281052 | 0.67 | SLC6A2 (0.37) | — | |
| SCHEMBL14447543 | 0.67 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL13891289 | 0.65 | — | — | |
| SCHEMBL15697771 | 0.63 | — | — | |
| SCHEMBL11025916 | 0.62 | — | — | |
| SCHEMBL3482028 | 0.62 | — | — | |
| SCHEMBL19224283 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006067800-A1 | TRIORGANOANTIMONY COMPOUNDS FOR PESTICIDAL USE | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2006-06-29 | — | — | WO | disclosed |