⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5690774 | 0.91 | — | — | |
| SCHEMBL9550861 | 0.68 | — | — | |
| SCHEMBL5690801 | 0.62 | — | — | |
| SCHEMBL15644347 | 0.60 | IDO1 (0.31) | — | |
| SCHEMBL9640457 | 0.60 | — | — | |
| SCHEMBL10073942 | 0.59 | GSK3B (0.35) | — | |
| SCHEMBL14166484 | 0.58 | — | — | |
| SCHEMBL27740003 | 0.57 | — | — | |
| SCHEMBL9241731 | 0.56 | — | — | |
| SCHEMBL9247008 | 0.56 | — | — |
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-20060229439-A1 | Monoazo compounds and process for preparing the same | KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) | 2006-10-12 | — | — | US | disclosed |
| EP-1650267-A1 | MONOAZO COMPOUND AND METHOD FOR PRODUCING SAME | Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) | 2006-04-26 | — | — | EP | disclosed |