⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12351464 | 0.87 | — | — | |
| SCHEMBL12698777 | 0.86 | — | — | |
| SCHEMBL20248289 | 0.79 | — | — | |
| SCHEMBL20248291 | 0.77 | — | — | |
| SCHEMBL17547401 | 0.76 | — | — | |
| SCHEMBL16803179 | 0.73 | — | — | |
| SCHEMBL16855485 | 0.72 | — | — | |
| SCHEMBL20248294 | 0.72 | — | — | |
| SCHEMBL20248296 | 0.71 | — | — | |
| SCHEMBL12321822 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080149891-A1 | STILBENE DERIVATIVES, LIQUID-CRYSTAL MIXTURES AND ELECTRO-OPTICAL DISPLAYS | MERCK PATENT GESELLSCHAFT (DE) | 2008-06-26 | — | — | US | disclosed |