⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6731581 | 0.99 | — | — | |
| SCHEMBL6734653 | 0.92 | DPP4 (0.31) | — | |
| SCHEMBL6723135 | 0.92 | DPP4 (0.31) | — | |
| SCHEMBL6726220 | 0.92 | DPP4 (0.31) | — | |
| SCHEMBL6723070 | 0.91 | DPP4 (0.31) | — | |
| SCHEMBL6730940 | 0.89 | — | — | |
| SCHEMBL6723148 | 0.88 | — | — | |
| SCHEMBL6723692 | 0.88 | — | — | |
| SCHEMBL6727484 | 0.87 | — | — | |
| SCHEMBL6728396 | 0.87 | — | — |
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-20040224251-A1 | Positive resist composition | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2004-11-11 | — | — | US | disclosed |