⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9982141 | 0.96 | — | — | |
| SCHEMBL9981432 | 0.86 | ALDH1A1 (0.30) | — | |
| SCHEMBL1738331 | 0.84 | — | — | |
| SCHEMBL9981918 | 0.84 | — | — | |
| SCHEMBL9981512 | 0.84 | KDM4E (0.31) | — | |
| SCHEMBL9982188 | 0.84 | — | — | |
| SCHEMBL9982032 | 0.83 | ALDH1A1 (0.37) | — | |
| SCHEMBL9982353 | 0.82 | EDNRB (0.30) | — | |
| SCHEMBL1739240 | 0.82 | GRM1 (0.31) | — | |
| SCHEMBL9981871 | 0.82 | ALDH1A1 (0.30) | — |
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-8211514-B2 | Reverse dispersion retardation film and liquid crystal display device using the same | JX NIPPON OIL & ENERGY CORPORATION (JP) | 2012-07-03 | — | — | US | disclosed |