⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19565158 | 0.96 | — | — | |
| SCHEMBL19565151 | 0.96 | — | — | |
| SCHEMBL17373228 | 0.95 | KDM4E (0.34) | — | |
| SCHEMBL17379795 | 0.95 | — | — | |
| SCHEMBL15832289 | 0.95 | — | — | |
| SCHEMBL15840222 | 0.95 | PDK2 (0.30) | — | |
| SCHEMBL15840189 | 0.95 | PDK2 (0.30) | — | |
| SCHEMBL17279359 | 0.95 | PDK2 (0.30) | — | |
| SCHEMBL15832287 | 0.94 | — | — | |
| SCHEMBL17379766 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3158597-B1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2020-09-23 | — | — | EP | disclosed |
| US-20170324044-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2017-11-09 | — | — | US | disclosed |
| US-20170324044-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2017-11-09 | — | — | US | disclosed |
| WO-2015192939-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2015-12-23 | — | — | WO | disclosed |