⚠ 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 | 0.99 | — | — | |
| SCHEMBL17419217 | 0.83 | ALOX5 (0.31) | — | |
| SCHEMBL6003914 | 0.82 | ALOX5 (0.31) | — | |
| SCHEMBL6099757 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL27872843 | 0.81 | ALOX5 (0.30) | — | |
| SCHEMBL1772836 | 0.79 | ALOX5 (0.30) | — | |
| SCHEMBL6101969 | 0.78 | — | — | |
| SCHEMBL6101518 | 0.78 | — | — | |
| SCHEMBL585686 | 0.77 | PTGS2 (0.35) | — | |
| SCHEMBL7155916 | 0.77 | — | — |
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-6429310-B2 | PHOTONIC OR ELECTRONIC ENERGY CONDUCTING | NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) | 2002-08-06 | — | — | US | disclosed |
| US-20010018515-A1 | Poly(porphyrin) having imidazolyl porphyrin metal complex as unit | NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) | 2001-08-30 | — | — | US | disclosed |