⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16133676 | 0.85 | MAPT (0.41) | — | |
| SCHEMBL16136313 | 0.80 | NPSR1 (0.40) | — | |
| SCHEMBL16768696 | 0.78 | TERT (0.34) | — | |
| SCHEMBL16768662 | 0.77 | RAB9A (0.32) | — | |
| SCHEMBL16060639 | 0.71 | MAPT (0.39) | — | |
| SCHEMBL22349126 | 0.68 | MAPT (0.37) | — | |
| SCHEMBL16768701 | 0.66 | EPHX2 (0.43) | — | |
| SCHEMBL31750938 | 0.66 | L3MBTL1 (0.40) | — | |
| SCHEMBL19864413 | 0.65 | MAPT (0.40) | — | |
| SCHEMBL16768660 | 0.65 | SSTR4 (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-9776996-B2 | Substituted 6,5-fused bicyclic heteroaryl compounds | Epizyme, Inc. (US) | 2017-10-03 | — | — | US | disclosed |
| US-9045477-B2 | Substituted 6,5-fused bicyclic heteroaryl compounds | Epizyme, Inc. (US) | 2015-06-02 | — | — | US | disclosed |