⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11370279 | 0.89 | — | — | |
| SCHEMBL9912596 | 0.84 | — | — | |
| SCHEMBL18472753 | 0.82 | — | — | |
| SCHEMBL13673470 | 0.79 | — | — | |
| SCHEMBL18069662 | 0.79 | — | — | |
| SCHEMBL12657312 | 0.79 | — | — | |
| SCHEMBL12328441 | 0.79 | — | — | |
| SCHEMBL9613639 | 0.79 | — | — | |
| SCHEMBL9607888 | 0.74 | — | — | |
| SCHEMBL12327972 | 0.72 | — | — |
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-2619284-B2 | LIQUID CRYSTAL DISPLAYS AND LIQUID CRYSTALLINE MEDIA WITH HOMEOTROPIC ALIGNMENT | MERCK PATENT GMBH (DE) | 2022-12-28 | — | — | EP | disclosed |