⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15685089 | 1.00 | — | — | |
| SCHEMBL19751495 | 1.00 | — | — | |
| SCHEMBL17081969 | 1.00 | — | — | |
| SCHEMBL17081972 | 1.00 | — | — | |
| SCHEMBL8313147 | 1.00 | — | — | |
| SCHEMBL15289260 | 1.00 | — | — | |
| SCHEMBL14414881 | 1.00 | — | — | |
| SCHEMBL12859570 | 1.00 | — | — | |
| SCHEMBL15760216 | 1.00 | — | — | |
| SCHEMBL12834913 | 1.00 | — | — |
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-1658350-B1 | COMPOUNDS FOR USE IN LIQUID CRYSTAL MEDIA | MERCK PATENT GMBH (DE) | 2010-01-20 | — | — | EP | disclosed |