⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL304561 | 0.77 | — | — | |
| SCHEMBL18611 | 0.74 | LRRK2 (0.46) | — | |
| SCHEMBL29533314 | 0.74 | LRRK2 (0.46) | — | |
| SCHEMBL363772 | 0.73 | — | — | |
| SCHEMBL3441158 | 0.73 | — | — | |
| SCHEMBL391339 | 0.73 | — | — | |
| SCHEMBL323572 | 0.73 | — | — | |
| SCHEMBL2969568 | 0.73 | — | — | |
| SCHEMBL130043 | 0.73 | — | — | |
| SCHEMBL130042 | 0.73 | — | — |
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-9193747-B2 | Organic electroluminescent device | UDC IRELAND LIMITED (IE) | 2015-11-24 | — | — | US | disclosed |
| EP-2043646-B1 | (E)-N-{3-(8-Chloro-11H-10-oxa-1-aza- dibenzo[a,d]cyclohepten-5-ylidene)-propyl]-phenyl} -methanesulfonamide as a GLUCOCORTICOID RECEPTOR MODULATOR AND METHODS OF USE | LILLY CO ELI (US) | 2012-05-16 | — | — | EP | disclosed |
| US-20100171111-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | FUJIFILM CORPORATION (JP) | 2010-07-08 | — | — | US | disclosed |