⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1397230 | 1.00 | — | — | |
| SCHEMBL12597691 | 1.00 | — | — | |
| SCHEMBL1396913 | 1.00 | — | — | |
| SCHEMBL18192993 | 0.95 | CYSLTR2 (0.48) | — | |
| SCHEMBL13971703 | 0.91 | — | — | |
| SCHEMBL10027690 | 0.91 | — | — | |
| SCHEMBL10014498 | 0.91 | — | — | |
| SCHEMBL1396780 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL14670343 | 0.90 | — | — | |
| SCHEMBL18192989 | 0.89 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8207343-B2 | Process for preparing montelukast and salts thereof | LAURUS LABS PRIVATE LIMITED (IN) | 2012-06-26 | — | — | US | disclosed |