⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2473514 | 0.82 | — | — | |
| SCHEMBL3462657 | 0.78 | MAP3K14 (0.43) | — | |
| SCHEMBL3462827 | 0.76 | MAP3K14 (0.32) | — | |
| SCHEMBL3462825 | 0.76 | MAP3K14 (0.32) | — | |
| SCHEMBL2470457 | 0.75 | OPRM1 (0.39) | — | |
| SCHEMBL13262952 | 0.68 | NPC1 (0.36) | — | |
| SCHEMBL2470566 | 0.65 | CREBBP (0.38) | — | |
| SCHEMBL2530347 | 0.65 | CCNA2 (0.34) | — | |
| SCHEMBL2534722 | 0.64 | ACHE (0.34) | — | |
| SCHEMBL2473575 | 0.64 | PDE4A (0.40) | — |
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-20110311485-A1 | 1,2,4-OXADIAZOLE DERIVATIVES AND THEIR THERAPEUTIC USE | ALMIRALL S.A. (ES) | 2011-12-22 | — | — | US | disclosed |
| EP-2202232-A1 | 1,2,4-oxadiazole derivatives and their therapeutic use | Laboratorios Almirall, S.A. (ES) | 2010-06-30 | — | — | EP | disclosed |