⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1470824 | 0.82 | — | — | |
| SCHEMBL608703 | 0.82 | — | — | |
| Water SCHEMBL28525471 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL1767196 | 0.67 | — | — | |
| SCHEMBL28406070 | 0.67 | — | — | |
| SCHEMBL12500570 | 0.67 | — | — | |
| Fluoride SCHEMBL1066932 | 0.67 | — | — | |
| Fluoride SCHEMBL11569014 | 0.67 | — | — | |
| Fluoride SCHEMBL5965381 | 0.67 | — | — | |
| Water SCHEMBL22716178 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2385072-A1 | NOVEL COMPOUND, POLYMERIZABLE COMPOSITION, COLOR FILTER AND PROCESS FOR PRODUCITON THEREOF, SOLID-STATE IMAGING ELEMENT, AND LITHOGRAPHIC PRINTING ORIGINAL PLATE | FUJIFILM Corporation (JP) | 2011-11-09 | — | — | EP | disclosed |