⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1067442 | 1.00 | — | — | |
| SCHEMBL21995575 | 1.00 | — | — | |
| SCHEMBL1067640 | 1.00 | — | — | |
| SCHEMBL1067641 | 1.00 | — | — | |
| SCHEMBL6752555 | 0.86 | — | — | |
| SCHEMBL6752554 | 0.86 | — | — | |
| SCHEMBL31564618 | 0.86 | SPHK1 (0.30) | — | |
| SCHEMBL6258657 | 0.83 | SPHK1 (0.31) | — | |
| SCHEMBL17135545 | 0.83 | — | — | |
| SCHEMBL6258655 | 0.83 | SPHK1 (0.31) | — |
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-2274297-A1 | PYRROLIDINONE GLUCOKINASE ACTIVATORS | F. Hoffmann-La Roche AG (CH) | 2011-01-19 | — | — | EP | disclosed |
| WO-2009127546-A1 | PYRROLIDINONE GLUCOKINASE ACTIVATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-10-22 | — | — | WO | disclosed |