⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19683840 | 0.98 | — | — | |
| SCHEMBL19394067 | 0.96 | — | — | |
| SCHEMBL19394210 | 0.95 | — | — | |
| SCHEMBL25124599 | 0.95 | — | — | |
| SCHEMBL25124582 | 0.95 | — | — | |
| SCHEMBL19683847 | 0.94 | — | — | |
| SCHEMBL19683882 | 0.94 | DNMT1 (0.32) | — | |
| SCHEMBL19683878 | 0.94 | DNMT1 (0.32) | — | |
| SCHEMBL19683972 | 0.94 | — | — | |
| SCHEMBL19849957 | 0.93 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3464244-B1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2021-11-17 | — | — | EP | disclosed |
| US-20190312203-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2019-10-10 | — | — | US | disclosed |
| WO-2017207596-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2017-12-07 | — | — | WO | disclosed |