⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL802512 | 0.99 | — | — | |
| SCHEMBL16773083 | 0.99 | — | — | |
| SCHEMBL802073 | 0.97 | PGR (0.32) | — | |
| SCHEMBL14960739 | 0.96 | TSPO (0.32) | — | |
| SCHEMBL15582794 | 0.96 | — | — | |
| SCHEMBL802182 | 0.96 | TSPO (0.32) | — | |
| SCHEMBL15582977 | 0.96 | PGR (0.31) | — | |
| SCHEMBL783385 | 0.95 | PGR (0.30) | — | |
| SCHEMBL16773635 | 0.95 | — | — | |
| SCHEMBL802135 | 0.95 | TSPO (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150155498-A1 | NOVEL ORGANIC ELECTROLUMINESCENCE COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE CONTAINING THE SAME | ROHM & HAAS ELECT MAT (KR) | 2015-06-04 | — | — | US | disclosed |
| US-20150155498-A1 | NOVEL ORGANIC ELECTROLUMINESCENCE COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE CONTAINING THE SAME | ROHM & HAAS ELECT MAT (KR) | 2015-06-04 | — | — | US | disclosed |