⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21089347 | 0.63 | — | — | |
| SCHEMBL21387911 | 0.59 | — | — | |
| SCHEMBL24772390 | 0.59 | — | — | |
| SCHEMBL14398869 | 0.59 | — | — | |
| SCHEMBL13864097 | 0.56 | — | — | |
| SCHEMBL14721494 | 0.56 | — | — | |
| SCHEMBL8922181 | 0.55 | — | — | |
| SCHEMBL12631048 | 0.55 | — | — | |
| SCHEMBL21089553 | 0.55 | — | — | |
| SCHEMBL4892487 | 0.53 | — | — |
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-3184510-B1 | IMPROVED PROCESSES FOR THE PREPARATION OF 1-ARYL-5-ALKYL PYRAZOLE COMPOUNDS | MERIAL INC (US) | 2019-06-12 | — | — | EP | disclosed |