⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12611521 | 1.00 | — | — | |
| SCHEMBL12887016 | 0.98 | — | — | |
| SCHEMBL19104612 | 0.97 | — | — | |
| SCHEMBL15313774 | 0.90 | — | — | |
| SCHEMBL12983315 | 0.89 | — | — | |
| SCHEMBL12131189 | 0.88 | GPR84 (0.31) | — | |
| SCHEMBL12131167 | 0.88 | GPR84 (0.31) | — | |
| SCHEMBL12131166 | 0.88 | GPR84 (0.31) | — | |
| SCHEMBL12131187 | 0.88 | GPR84 (0.31) | — | |
| SCHEMBL12611647 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110309350-A1 | COMPOUND AND DEVICE USING SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-12-22 | — | — | US | disclosed |
| US-20110303293-A1 | COMPOSITION AND DEVICE USING SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-12-15 | — | — | US | disclosed |