⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27916842 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL515462 | 0.69 | — | — | |
| SCHEMBL251279 | 0.69 | — | — | |
| SCHEMBL7828116 | 0.69 | — | — | |
| SCHEMBL3115191 | 0.69 | — | — | |
| SCHEMBL8167995 | 0.69 | — | — | |
| SCHEMBL26980356 | 0.69 | — | — | |
| SCHEMBL1355822 | 0.69 | — | — | |
| SCHEMBL5044080 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL634374 | 0.67 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7998540-B2 | Substituted anthracenes | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2011-08-16 | — | — | US | disclosed |
| WO-2011039506-A1 | ELECTROLUMINESCENT MATERIALS COMPRISING FLUORENE DERIVATIVES | LOMOX LIMITED (GB) | 2011-04-07 | — | — | WO | disclosed |
| US-20110015404-A1 | Electroluminescent Materials | LOMOX LIMITED (GB) | 2011-01-20 | — | — | US | disclosed |
| EP-1644460-B1 | SUBSTITUTED ANTHRACENES | MERCK PATENT GMBH (DE) | 2008-01-30 | — | — | EP | disclosed |
| US-20070014934-A1 | Substituted anthracenes | MERCK PATENT GMBH (DE) | 2007-01-18 | — | — | US | disclosed |
| EP-1644460-A1 | SUBSTITUTED ANTHRACENES | MERCK PATENT GmbH (DE) | 2006-04-12 | — | — | EP | disclosed |
| WO-2005005572-A1 | SUBSTITUTED ANTHRACENES | MERCK PATENT GMBH (DE) | 2005-01-20 | — | — | WO | disclosed |