⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL714076 | 1.00 | — | — | |
| SCHEMBL27873763 | 0.86 | NLRP3 (0.30) | — | |
| SCHEMBL716409 | 0.86 | — | — | |
| SCHEMBL17443154 | 0.86 | — | — | |
| SCHEMBL31558054 | 0.81 | — | — | |
| SCHEMBL12275677 | 0.78 | TTR (0.33) | — | |
| SCHEMBL10831461 | 0.77 | LMNA (0.39) | — | |
| SCHEMBL27616844 | 0.77 | HSD17B10 (0.33) | — | |
| SCHEMBL3941195 | 0.76 | — | — | |
| SCHEMBL7262219 | 0.74 | MEN1 (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 |
|---|---|---|---|---|---|---|---|
| US-20170174833-A1 | HIGH-FLUIDITY POLYCARBONATE COPOLYMER, PROCESS FOR PRODUCTION HIGHLY POLYMERIZED AROMATIC POLYCARBONATE RESIN AND AROMATIC POLYCARBONATE COMPOUND | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2017-06-22 | — | — | US | disclosed |
| EP-1158363-B1 | Positive resist composition and onium salts of saccharin derivatives | FUJIFILM CORP (JP) | 2014-01-22 | — | — | EP | disclosed |