⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17544930 | 0.83 | GRIN2D (0.32) | — | |
| SCHEMBL17683848 | 0.81 | GRIN2D (0.32) | — | |
| SCHEMBL17544969 | 0.74 | GRIN2D (0.32) | — | |
| SCHEMBL17544743 | 0.71 | CNR2 (0.32) | — | |
| SCHEMBL17545158 | 0.69 | EHMT2 (0.40) | — | |
| SCHEMBL13737823 | 0.68 | KDM4E (0.38) | — | |
| SCHEMBL17544666 | 0.67 | EHMT2 (0.44) | — | |
| SCHEMBL17544842 | 0.64 | CNR2 (0.33) | — | |
| SCHEMBL17544594 | 0.64 | AGTR1 (0.33) | — | |
| SCHEMBL17544819 | 0.61 | PDE6D (0.40) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9802941-B2 | Compounds and methods for inhibiting histone demethylases | GILEAD SCIENCES, INC. (US) | 2017-10-31 | — | — | US | disclosed |
| EP-3186238-A1 | COMPOUNDS AND METHODS FOR INHIBITING HISTONE DEMETHYLASES | GILEAD SCIENCES, INC. (US) | 2017-07-05 | — | — | EP | disclosed |
| US-20160102096-A1 | COMPOUNDS AND METHODS FOR INHIBITING HISTONE DEMETHYLASES | EPITHERAPEUTICS APS | 2016-04-14 | — | — | US | disclosed |
| WO-2016033169-A1 | COMPOUNDS AND METHODS FOR INHIBITING HISTONE DEMETHYLASES | EPITHERAPEUTICS APS (US) | 2016-03-03 | — | — | WO | disclosed |