⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18513569 | 1.00 | — | — | |
| SCHEMBL13953138 | 0.86 | — | — | |
| SCHEMBL8924882 | 0.83 | — | — | |
| SCHEMBL9204044 | 0.79 | PRMT5 (0.31) | — | |
| SCHEMBL18513576 | 0.78 | — | — | |
| SCHEMBL2092407 | 0.78 | — | — | |
| SCHEMBL18513690 | 0.78 | — | — | |
| SCHEMBL5986536 | 0.78 | — | — | |
| SCHEMBL8924887 | 0.78 | — | — | |
| SCHEMBL9200570 | 0.76 | PRMT5 (0.30) | — |
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-2017024408-A1 | ARYL-SUBSTITUTED DIHYDROQUINOLINONES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS | NEOMED INSTITUTE (CA) | 2017-02-16 | — | — | WO | disclosed |