⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7161176 | 0.78 | — | — | |
| SCHEMBL6099757 | 0.77 | — | — | |
| SCHEMBL7717025 | 0.77 | — | — | |
| SCHEMBL6101518 | 0.73 | — | — | |
| SCHEMBL2314604 | 0.73 | RARB (0.51) | — | |
| SCHEMBL2310945 | 0.73 | RARB (0.51) | — | |
| SCHEMBL6101969 | 0.72 | — | — | |
| SCHEMBL8198894 | 0.71 | ESR1 (0.41) | — | |
| SCHEMBL2319620 | 0.70 | MAPT (0.43) | — | |
| SCHEMBL1410169 | 0.69 | SMN1; SMN2 (0.44) | — |
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-6602998-B2 | Connector for energy transfer devices; photosynthesis sytems; solar cells | NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) | 2003-08-05 | — | — | US | disclosed |
| US-20010027252-A1 | Novel mercapto-substitued imidazolylporphyrin metal complex monomer, polymer having the same as a repeating unit and method of preparing the same | NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) | 2001-10-04 | — | — | US | disclosed |