⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3249412 | 0.91 | — | — | |
| SCHEMBL3245661 | 0.87 | KDM4E (0.34) | — | |
| SCHEMBL3250995 | 0.87 | PKM (0.34) | — | |
| SCHEMBL3249777 | 0.86 | ALOX5AP (0.33) | — | |
| SCHEMBL3241920 | 0.86 | KDM4E (0.38) | — | |
| SCHEMBL3251021 | 0.81 | MAPT (0.32) | — | |
| SCHEMBL3245575 | 0.81 | HPGD (0.34) | — | |
| SCHEMBL3252457 | 0.79 | KDM4E (0.38) | — | |
| SCHEMBL3250779 | 0.78 | PKM (0.34) | — | |
| SCHEMBL3253986 | 0.77 | KDM4E (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1899335-B1 | PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS | PF MEDICAMENT (FR) | 2010-05-19 | — | — | EP | claimed |