⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19277709 | 0.74 | — | — | |
| SCHEMBL6752599 | 0.67 | — | — | |
| SCHEMBL21349640 | 0.67 | — | — | |
| SCHEMBL8348870 | 0.63 | HTR5A (0.30) | — | |
| SCHEMBL19011457 | 0.63 | — | — | |
| SCHEMBL2813711 | 0.58 | — | — | |
| SCHEMBL22276788 | 0.54 | — | — | |
| SCHEMBL21305084 | 0.54 | — | — | |
| SCHEMBL789371 | 0.47 | — | — | |
| SCHEMBL321091 | 0.46 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017143059-A1 | MAX BINDERS AS MYC MODULATORS AND USES THEREOF | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2017-08-24 | — | — | WO | disclosed |