⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1260669 | 0.89 | — | — | |
| SCHEMBL5131874 | 0.75 | FAAH (0.39) | — | |
| SCHEMBL9744931 | 0.73 | — | — | |
| SCHEMBL8053041 | 0.69 | — | — | |
| SCHEMBL5963901 | 0.67 | FAAH (0.32) | — | |
| SCHEMBL1790074 | 0.67 | ALDH1A1 (0.35) | — | |
| SCHEMBL1790076 | 0.67 | ALDH1A1 (0.35) | — | |
| SCHEMBL7609179 | 0.66 | — | — | |
| SCHEMBL124489 | 0.65 | CA2 (0.30) | — | |
| SCHEMBL10898287 | 0.65 | — | — |
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-20070197718-A1 | Photofunctional optical material comprising fluorine-containing acrylate polymer | DAIKIN INDUSTRIES LTD. | 2007-08-23 | — | — | US | disclosed |
| EP-1734074-A1 | PHOTOFUNCTIONAL OPTICAL MATERIAL COMPRISING FLUORINATED ACRYLATE POLYMER | Daikin Industries, Ltd. (JP) | 2006-12-20 | — | — | EP | disclosed |
| US-20050261264-A1 | Rare-earth ternary complex | NISSEI CHEMICALS INC. (JP) | 2005-11-24 | — | — | US | disclosed |
| EP-1318143-A1 | RARE-EARTH TERNARY COMPLEX | Yanagida, Shozo (JP) | 2003-06-11 | — | — | EP | disclosed |