⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25070566 | 0.83 | APP (0.46) | — | |
| SCHEMBL25070558 | 0.82 | — | — | |
| SCHEMBL20176724 | 0.82 | KDM4E (0.40) | — | |
| SCHEMBL24990322 | 0.80 | ESR1 (0.30) | — | |
| SCHEMBL21608694 | 0.77 | APP (0.34) | — | |
| SCHEMBL25070448 | 0.75 | ESR1 (0.31) | — | |
| SCHEMBL25070503 | 0.75 | — | — | |
| SCHEMBL353810 | 0.75 | PRKCI (0.40) | — | |
| SCHEMBL356229 | 0.75 | PRKCI (0.40) | — | |
| SCHEMBL18217182 | 0.74 | SMN1; SMN2 (0.32) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023094404-A1 | LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY | MERCK PATENT GMBH (DE) | 2023-06-01 | — | — | WO | disclosed |
| US-20230053362-A1 | DICHROIC DYE COMPOSITION | MERCK PATENT GMBH (DE) | 2023-02-23 | — | — | US | disclosed |
| WO-2023012202-A1 | SWITCHING LAYERS FOR USE IN A WINDOW ELEMENT | MERCK PATENT GMBH (DE) | 2023-02-09 | — | — | WO | disclosed |