⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27337439 | 0.94 | KDM4E (0.56) | — | |
| SCHEMBL1562 | 0.94 | — | — | |
| SCHEMBL29728146 | 0.89 | — | — | |
| Ammonia Solution, Strong SCHEMBL4926226 | 0.89 | — | — | |
| Bromide SCHEMBL29682024 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL6618237 | 0.89 | — | — | |
| Water SCHEMBL2714950 | 0.89 | — | — | |
| SCHEMBL6101097 | 0.89 | — | — | |
| SCHEMBL2723477 | 0.89 | KDM4E (0.50) | — | |
| Hydrochloric Acid SCHEMBL2125050 | 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 |
|---|---|---|---|---|---|---|---|
| WO-2007088545-A2 | NOVEL PROCESS FOR PREPARING 1-(MERCAPTOMETHYL) CYCLOPROPANEACETIC ACID, A USEFUL INTERMEDIATE IN THE PREPARATION OF MONTELUKAST AND SALTS THEREOF | CHEMAGIS LTD. (IL) | 2007-08-09 | — | — | WO | disclosed |