⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7713490 | 0.79 | — | — | |
| SCHEMBL1276623 | 0.72 | — | — | |
| SCHEMBL82982 | 0.65 | — | — | |
| SCHEMBL1039320 | 0.63 | — | — | |
| SCHEMBL1039321 | 0.63 | — | — | |
| SCHEMBL5707161 | 0.62 | — | — | |
| SCHEMBL7139344 | 0.61 | — | — | |
| SCHEMBL21706322 | 0.61 | — | — | |
| SCHEMBL8210237 | 0.61 | — | — | |
| SCHEMBL52382 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6166157-A | Iodonitriles as chain transfer agents in the manufacture of perfluoropolymers | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2000-12-26 | — | — | US | disclosed |
| EP-0868447-B1 | IODONITRILES AS CHAIN TRANSFER AGENTS IN THE MANUFACTURE OF PERFLUOROPOLYMERS | DU PONT (US) | 2000-02-23 | — | — | EP | disclosed |