⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13256039 | 1.00 | — | — | |
| SCHEMBL20621700 | 1.00 | — | — | |
| SCHEMBL17787936 | 0.80 | — | — | |
| SCHEMBL20888362 | 0.80 | — | — | |
| SCHEMBL17189605 | 0.80 | — | — | |
| SCHEMBL18726719 | 0.74 | — | — | |
| SCHEMBL25044194 | 0.73 | — | — | |
| SCHEMBL13645487 | 0.72 | ALDH1A1 (0.32) | — | |
| SCHEMBL14534318 | 0.66 | — | — | |
| SCHEMBL22560467 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2123795-A1 | METHOD FOR PRODUCING IODIZING AGENT AND METHOD FOR PRODUCING AROMATIC IODINE COMPOUND | Japan Science and Technology Agency (JP) | 2009-11-25 | — | — | EP | disclosed |