⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14948362 | 0.78 | CYP2C19 (0.33) | — | |
| SCHEMBL14948367 | 0.72 | S1PR1 (0.33) | — | |
| SCHEMBL14948339 | 0.70 | KDM4E (0.37) | — | |
| SCHEMBL14981535 | 0.69 | TAAR1 (0.38) | — | |
| SCHEMBL19320270 | 0.69 | TAAR1 (0.38) | — | |
| SCHEMBL13699887 | 0.68 | ALDH1A1 (0.42) | — | |
| SCHEMBL10062458 | 0.67 | S1PR1 (0.41) | — | |
| SCHEMBL21727707 | 0.67 | S1PR1 (0.41) | — | |
| SCHEMBL14981814 | 0.67 | TAAR1 (0.44) | — | |
| SCHEMBL14981536 | 0.67 | S1PR1 (0.40) | — |
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-9184388-B2 | Layered structure, electronic device using same, aromatic compound, and method for manufacturing said compound | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2015-11-10 | — | — | US | disclosed |
| US-20130119369-A1 | LAYERED STRUCTURE, ELECTRONIC DEVICE USING SAME, AROMATIC COMPOUND, AND METHOD FOR MANUFACTURING SAID COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-05-16 | — | — | US | disclosed |