⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6062101 | 0.92 | ALDH1A1 (0.39) | — | |
| SCHEMBL1492457 | 0.89 | — | — | |
| SCHEMBL5011308 | 0.81 | HRH3 (0.47) | — | |
| SCHEMBL21680747 | 0.80 | — | — | |
| SCHEMBL12853144 | 0.77 | NCF1 (0.37) | — | |
| SCHEMBL23096811 | 0.75 | THRB (0.35) | — | |
| SCHEMBL31035976 | 0.73 | CYP1A2 (0.41) | — | |
| SCHEMBL16135444 | 0.73 | CYP1A2 (0.41) | — | |
| SCHEMBL14867197 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL4745599 | 0.72 | CYP1A2 (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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118598873-B | Preparation method of chiral aza-quinoline compound | 艾斯拓康生物医药(天津)有限公司 | 2024-11-19 | — | — | CN | disclosed |
| CN-118598873-A | Preparation method of chiral aza-quinoline compound | 艾斯拓康生物医药(天津)有限公司 | 2024-09-06 | — | — | CN | disclosed |
| US-11147272-B2 | Pyridone compounds and agricultural and horticultural fungicides comprising the same as active ingredients | MITSUI CHEMICALS ARGRO, INC. (JP) | 2021-10-19 | — | — | US | disclosed |
| EP-3611164-A1 | PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT | Mitsui Chemicals Agro, Inc. (JP) | 2020-02-19 | — | — | EP | disclosed |
| US-20200045963-A1 | PYRIDONE COMPOUNDS AND AGRICULTURAL AND HORTICULTURAL FUNGICIDES COMPRISING THE SAME AS ACTIVE INGREDIENTS | MITSUI CHEMICALS AGRO, INC. (JP) | 2020-02-13 | — | — | US | disclosed |