⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17792526 | 0.72 | CYP1A2 (0.33) | — | |
| SCHEMBL16402446 | 0.70 | — | — | |
| SCHEMBL16402607 | 0.64 | KDM4E (0.35) | — | |
| SCHEMBL29243578 | 0.56 | PRMT5 (0.32) | — | |
| SCHEMBL4924021 | 0.55 | MPO (0.44) | — | |
| SCHEMBL15233559 | 0.51 | NOTUM (0.30) | — | |
| Trifluoroacetic Acid SCHEMBL22506795 | 0.50 | HRH4 (0.33) | — | |
| SCHEMBL9881275 | 0.50 | ADRA2C (0.32) | — | |
| SCHEMBL22278145 | 0.49 | HTR2A (0.33) | — | |
| SCHEMBL24332723 | 0.48 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10150764-B2 | Substituted benzene compounds | Epizyme, Inc. (US) | 2018-12-11 | — | — | US | disclosed |
| EP-3022184-B1 | SUBSTITUTED BENZENE COMPOUNDS | EPIZYME INC (US) | 2017-09-27 | — | — | EP | disclosed |
| US-20160194316-A1 | SUBSTITUTED BENZENE COMPOUNDS | Epizyme, Inc. | 2016-07-07 | — | — | US | disclosed |
| EP-3022184-A1 | SUBSTITUTED BENZENE COMPOUNDS | Epizyme, Inc. (US) | 2016-05-25 | — | — | EP | disclosed |
| WO-2015010049-A1 | SUBSTITUTED BENZENE COMPOUNDS | Epizyme, Inc. (US) | 2015-01-22 | — | — | WO | disclosed |