⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7628905 | 0.59 | — | — | |
| SCHEMBL21975346 | 0.59 | — | — | |
| SCHEMBL17006281 | 0.57 | — | — | |
| SCHEMBL19367415 | 0.56 | — | — | |
| SCHEMBL21335896 | 0.56 | — | — | |
| SCHEMBL9246880 | 0.53 | — | — | |
| SCHEMBL11579920 | 0.51 | — | — | |
| SCHEMBL7632781 | 0.49 | — | — | |
| SCHEMBL10799768 | 0.48 | — | — | |
| SCHEMBL17175001 | 0.48 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20210363159-A1 | HETEROCYCLIC COMPOUND FOR USE IN ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2021-11-25 | — | — | US | disclosed |
| US-10510960-B2 | Materials for organic electroluminescent devices | MERCK PATENT GMBH (DE) | 2019-12-17 | — | — | US | disclosed |
| US-20170338414-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2017-11-23 | — | — | US | disclosed |