⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15338705 | 0.78 | — | — | |
| SCHEMBL300640 | 0.71 | — | — | |
| SCHEMBL1564365 | 0.69 | — | — | |
| SCHEMBL2738429 | 0.67 | — | — | |
| SCHEMBL8718327 | 0.67 | — | — | |
| SCHEMBL4490176 | 0.67 | — | — | |
| SCHEMBL8559299 | 0.67 | — | — | |
| SCHEMBL11858888 | 0.67 | — | — | |
| SCHEMBL1564363 | 0.67 | — | — | |
| SCHEMBL20921301 | 0.65 | — | — |
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-2014165827-A1 | PPAR AGONISTS | SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) | 2014-10-09 | — | — | WO | disclosed |