⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10978344 | 0.78 | — | — | |
| SCHEMBL29019775 | 0.77 | — | — | |
| SCHEMBL8375373 | 0.75 | — | — | |
| SCHEMBL8226617 | 0.75 | — | — | |
| SCHEMBL11274187 | 0.73 | — | — | |
| SCHEMBL1976598 | 0.71 | — | — | |
| SCHEMBL13262582 | 0.71 | — | — | |
| SCHEMBL19523425 | 0.71 | — | — | |
| SCHEMBL8373104 | 0.71 | — | — | |
| SCHEMBL14979530 | 0.71 | — | — |
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-8410159-B2 | Imidazole compounds having pharmaceutical activity towards the sigma receptor | LABORATORIES DEL DR. ESTEVE, S.A. (ES) | 2013-04-02 | — | — | US | disclosed |
| US-20120059006-A1 | SIGMA RECEPTOR INHIBITORS | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2012-03-08 | — | — | US | disclosed |