⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3036355 | 0.77 | KDM4E (0.31) | — | |
| SCHEMBL13773197 | 0.77 | — | — | |
| SCHEMBL13773200 | 0.77 | — | — | |
| SCHEMBL13773206 | 0.77 | — | — | |
| SCHEMBL13773196 | 0.77 | — | — | |
| SCHEMBL4891102 | 0.77 | — | — | |
| SCHEMBL16581442 | 0.77 | — | — | |
| SCHEMBL4881996 | 0.75 | — | — | |
| SCHEMBL5698911 | 0.75 | — | — | |
| SCHEMBL1232525 | 0.74 | TFPI2 (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 |
|---|---|---|---|---|---|---|---|
| US-4279717-A | USING BIS-ARYL IODONIUM SALT CATALYST | GENERAL ELECTRIC COMPANY (US) | 1981-07-21 | — | — | US | claimed |
| US-5955002-A | Method for determining properties of a polymer coating or film cured by cationic polymerization | SPECTRA GROUP LIMITED, INC. (US) | 1999-09-21 | — | — | US | disclosed |