⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL564052 | 0.81 | — | — | |
| SCHEMBL9820154 | 0.79 | CYP1A2 (0.53) | — | |
| SCHEMBL16751990 | 0.78 | CYP1A2 (0.47) | — | |
| SCHEMBL31509049 | 0.76 | CYP1A2 (0.50) | — | |
| SCHEMBL30886698 | 0.76 | CYP1A2 (0.50) | — | |
| SCHEMBL7903270 | 0.75 | — | — | |
| SCHEMBL14639046 | 0.75 | — | — | |
| SCHEMBL971556 | 0.75 | — | — | |
| SCHEMBL7901480 | 0.75 | — | — | |
| SCHEMBL17234599 | 0.74 | CYP1A2 (0.43) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109983003-B | Diaryl pyrazole compound and pest control agent | 日本曹达株式会社 | 2022-06-03 | — | — | CN | disclosed |
| US-8217029-B2 | Oxazolidinone antibiotics | ACTELION PHARMACEUTICALS LTD (CH) | 2012-07-10 | — | — | US | disclosed |
| US-20110039823-A1 | OXAZOLIDINONE ANTIBIOTICS | ACTELION PHARMACEUTICALS LTD (CH) | 2011-02-17 | — | — | US | disclosed |