⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28959894 | 0.79 | PTGS1 (0.37) | — | |
| SCHEMBL438366 | 0.77 | — | — | |
| SCHEMBL7161679 | 0.77 | — | — | |
| SCHEMBL1324470 | 0.74 | NFKB1 (0.38) | — | |
| SCHEMBL9440074 | 0.74 | NFKB1 (0.38) | — | |
| Water SCHEMBL28728487 | 0.74 | — | — | |
| SCHEMBL2127293 | 0.74 | PTGS1 (0.34) | — | |
| SCHEMBL28716313 | 0.72 | — | — | |
| SCHEMBL821284 | 0.71 | TSHR (0.34) | — | |
| SCHEMBL3212369 | 0.70 | ADH1B (0.38) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5200438-A | Printing; shrinkage inhibition; aging-crack resistance; high adhesion; chemical resistance; scratch resistance | HAYAKAWA RUBBER CO., LTD. (JP) | 1993-04-06 | — | — | US | claimed |
| EP-0331841-B1 | ULTRAVIOLET-CURABLE INK | HAYAKAWA RUBBER COMPANY LIMITED (JP) | 1993-04-07 | — | — | EP | disclosed |
| US-5200438-A | Printing; shrinkage inhibition; aging-crack resistance; high adhesion; chemical resistance; scratch resistance | HAYAKAWA RUBBER CO., LTD. (JP) | 1993-04-06 | — | — | US | disclosed |
| EP-0331841-A2 | Ultraviolet-curable ink | HAYAKAWA RUBBER COMPANY LIMITED (JP) | 1989-09-13 | — | — | EP | disclosed |