⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17624510 | 0.81 | — | — | |
| SCHEMBL19498152 | 0.77 | — | — | |
| SCHEMBL21540401 | 0.77 | — | — | |
| SCHEMBL19504481 | 0.74 | HSD11B1 (0.36) | — | |
| SCHEMBL20368774 | 0.72 | KMT2A (0.41) | — | |
| SCHEMBL684218 | 0.71 | — | — | |
| SCHEMBL25124486 | 0.68 | TSHR (0.34) | — | |
| SCHEMBL24921073 | 0.67 | — | — | |
| SCHEMBL12523638 | 0.66 | TSHR (0.37) | — | |
| SCHEMBL24525704 | 0.66 | TSHR (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170305922-A1 | CARM1 INHIBITORS AND USES THEREOF | Epizyme, Inc. (US) | 2017-10-26 | — | — | US | disclosed |