⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11662304 | 0.76 | OPRM1 (0.42) | — | |
| SCHEMBL7510941 | 0.76 | — | — | |
| SCHEMBL336767 | 0.75 | LMNA (0.45) | — | |
| SCHEMBL337364 | 0.75 | LMNA (0.45) | — | |
| SCHEMBL1580145 | 0.73 | — | — | |
| SCHEMBL3977628 | 0.72 | LMNA (0.48) | — | |
| SCHEMBL19614469 | 0.72 | — | — | |
| SCHEMBL19614451 | 0.72 | — | — | |
| SCHEMBL19614449 | 0.72 | — | — | |
| SCHEMBL1419848 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8785452-B2 | Anti-infective compounds | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) | 2014-07-22 | — | — | US | disclosed |
| EP-2730576-A2 | Anti-infective compounds | Institut Pasteur Korea (KR) | 2014-05-14 | — | — | EP | disclosed |
| US-20110178077-A1 | Anti-infective compounds | INSTITUT PASTEUR KOREA (KR) | 2011-07-21 | — | — | US | disclosed |