⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17623451 | 0.76 | — | — | |
| SCHEMBL14617945 | 0.75 | — | — | |
| SCHEMBL21507861 | 0.74 | — | — | |
| SCHEMBL22061878 | 0.72 | — | — | |
| SCHEMBL12978346 | 0.72 | — | — | |
| SCHEMBL8231380 | 0.72 | — | — | |
| SCHEMBL3057444 | 0.70 | — | — | |
| SCHEMBL322851 | 0.70 | — | — | |
| SCHEMBL15780426 | 0.70 | — | — | |
| SCHEMBL3085304 | 0.68 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3943087-A1 | HETEROARYL COMPOUNDS AND USES THEREOF | Celgene CAR LLC (BM) | 2022-01-26 | — | — | EP | disclosed |
| EP-2116533-A1 | GLUCOKINASE ACTIVATOR | Kyorin Pharmaceutical Co., Ltd. (JP) | 2009-11-11 | — | — | EP | disclosed |