⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14818438 | 0.87 | — | — | |
| SCHEMBL3146161 | 0.84 | — | — | |
| Bromide SCHEMBL19439576 | 0.81 | — | — | |
| Diethylamine SCHEMBL27825491 | 0.79 | TSHR (0.59) | — | |
| SCHEMBL1456840 | 0.79 | — | — | |
| SCHEMBL30229751 | 0.78 | — | — | |
| SCHEMBL80292 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL4655497 | 0.77 | — | — | |
| SCHEMBL31574129 | 0.76 | KDM4E (0.32) | — | |
| SCHEMBL22951124 | 0.74 | CYP2C19 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014144169-A1 | CARM1 INHIBITORS AND USES THEREOF | Epizyme, Inc. (US) | 2014-09-18 | — | — | WO | disclosed |
| WO-2013039876-A1 | SILYL-CONTAINING HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES | MERCK SHARP & DOHME CORP. (US) | 2013-03-21 | — | — | WO | disclosed |