⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1133401 | 0.89 | — | — | |
| SCHEMBL1133408 | 0.89 | — | — | |
| SCHEMBL1133404 | 0.89 | — | — | |
| SCHEMBL1133402 | 0.89 | — | — | |
| SCHEMBL14208988 | 0.88 | CYSLTR2 (0.54) | — | |
| SCHEMBL12200411 | 0.88 | CYSLTR2 (0.54) | — | |
| SCHEMBL2547277 | 0.86 | — | — | |
| SCHEMBL1132498 | 0.86 | — | — | |
| SCHEMBL2734690 | 0.85 | CYSLTR1 (0.73) | — | |
| SCHEMBL2850594 | 0.85 | CYSLTR1 (0.73) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1948611-B1 | Process for the preparation of a leukotriene antagonist and intermediates thereof | ESTEVE QUIMICA SA (ES) | 2012-05-23 | — | — | EP | disclosed |
| US-20080306270-A1 | Process for the Preparation of a Leukotriene Antagonist and Intermediates Thereof | Esteve Química, S.A. (ES) | 2008-12-11 | — | — | US | disclosed |
| EP-1783117-A1 | Process for the preparation of a leukotriene antagonist and intermediates thereof | ESTEVE QUIMICA, S.A. (ES) | 2007-05-09 | — | — | EP | disclosed |