⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12157566 | 0.76 | — | — | |
| SCHEMBL1867686 | 0.73 | — | — | |
| SCHEMBL896223 | 0.73 | — | — | |
| SCHEMBL29002357 | 0.73 | — | — | |
| SCHEMBL8167932 | 0.73 | — | — | |
| SCHEMBL1867688 | 0.73 | — | — | |
| SCHEMBL7898760 | 0.71 | — | — | |
| SCHEMBL342544 | 0.71 | NOS2 (0.33) | — | |
| SCHEMBL28290144 | 0.70 | — | — | |
| SCHEMBL3298616 | 0.69 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1700890-B1 | Ink composition, inkjet recording method, printed material, method of producing planographic printing plate, and planographic printing plate | FUJIFILM CORP (JP) | 2011-08-24 | — | — | EP | disclosed |
| US-20060204732-A1 | Ink composition, inkjet recording method, printed material, method of producing planographic printing plate, and planographic printing plate | FUJI PHOTO FILM CO., LTD. | 2006-09-14 | — | — | US | disclosed |
| EP-1700890-A2 | Ink composition, inkjet recording method, printed material, method of producing planographic printing plate, and planographic printing plate | FUJI PHOTO FILM CO., LTD. (JP) | 2006-09-13 | — | — | EP | disclosed |