⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4562013 | 0.80 | — | — | |
| SCHEMBL6557726 | 0.78 | — | — | |
| SCHEMBL11367724 | 0.77 | — | — | |
| SCHEMBL3265447 | 0.75 | — | — | |
| SCHEMBL6047069 | 0.74 | KDM4E (0.31) | — | |
| SCHEMBL465931 | 0.73 | — | — | |
| SCHEMBL18277278 | 0.73 | — | — | |
| SCHEMBL87512 | 0.73 | — | — | |
| SCHEMBL8982707 | 0.73 | — | — | |
| SCHEMBL465932 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4579926-A | CATALYTIC POLYMERIZATION OF MONOMER SOLUTION; SUBJECTING TO DIALYSIS PROCESS | EXXON RESEARCH AND ENGINEERING CO. (US) | 1986-04-01 | — | — | US | disclosed |