⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22910621 | 0.85 | — | — | |
| SCHEMBL12417115 | 0.76 | — | — | |
| SCHEMBL15491974 | 0.76 | — | — | |
| SCHEMBL1145942 | 0.76 | — | — | |
| SCHEMBL1715996 | 0.76 | — | — | |
| SCHEMBL1145946 | 0.76 | — | — | |
| SCHEMBL23240937 | 0.76 | — | — | |
| SCHEMBL21037816 | 0.76 | — | — | |
| SCHEMBL13455410 | 0.74 | TSHR (0.38) | — | |
| Hydrochloric Acid SCHEMBL1715760 | 0.74 | — | — |
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-10913720-B2 | Benzyloxypyridylcyclopropanecarboxylic acids, pharmaceutical compositions and uses thereof | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2021-02-09 | — | — | US | disclosed |