⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17718582 | 1.00 | — | — | |
| SCHEMBL13141355 | 0.89 | CYP2C19 (0.33) | — | |
| SCHEMBL25939779 | 0.89 | CYP2C19 (0.33) | — | |
| SCHEMBL9750758 | 0.87 | — | — | |
| SCHEMBL17722548 | 0.80 | — | — | |
| SCHEMBL25807944 | 0.80 | — | — | |
| SCHEMBL13302441 | 0.80 | PTGS1 (0.37) | — | |
| SCHEMBL26537516 | 0.77 | — | — | |
| SCHEMBL13179248 | 0.76 | — | — | |
| SCHEMBL24741367 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20160122342-A1 | ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) | 2016-05-05 | — | — | US | disclosed |
| US-20160122342-A1 | ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) | 2016-05-05 | — | — | US | disclosed |