⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1393998 | 0.83 | — | — | |
| SCHEMBL1198354 | 0.82 | CYP2A6 (0.37) | — | |
| SCHEMBL5797199 | 0.80 | MAPT (0.43) | — | |
| SCHEMBL2433245 | 0.77 | NPC1 (0.33) | — | |
| SCHEMBL4489657 | 0.77 | CYP2A6 (0.56) | — | |
| SCHEMBL1925074 | 0.77 | GOT1 (0.33) | — | |
| SCHEMBL155358 | 0.77 | KDM4E (0.52) | — | |
| SCHEMBL4590846 | 0.77 | MAPK14 (0.35) | — | |
| SCHEMBL6188099 | 0.75 | NOTUM (0.37) | — | |
| SCHEMBL7145529 | 0.75 | NOTUM (0.38) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080166591-A1 | CARBAZOLE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | CANON KABUSHIKI KAISHA (JP) | 2008-07-10 | — | — | US | disclosed |