⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22083922 | 0.74 | — | — | |
| SCHEMBL1086082 | 0.74 | — | — | |
| SCHEMBL21719743 | 0.69 | — | — | |
| SCHEMBL21719953 | 0.69 | PKM (0.33) | — | |
| SCHEMBL21719520 | 0.69 | — | — | |
| SCHEMBL7139360 | 0.67 | — | — | |
| SCHEMBL21720715 | 0.65 | — | — | |
| SCHEMBL19077923 | 0.63 | — | — | |
| SCHEMBL21737402 | 0.61 | — | — | |
| SCHEMBL1075523 | 0.61 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3611165-B1 | PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT | MITSUI CHEMICALS CROP & LIFE SOLUTIONS INC (JP) | 2023-08-16 | — | — | EP | disclosed |
| EP-3177612-B1 | OPTIONALLY FUSED HETEROCYCLYL-SUBSTITUTED DERIVATIVES OF PYRIMIDINE USEFUL FOR THE TREATMENT OF INFLAMMATORY, METABOLIC, ONCOLOGIC AND AUTOIMMUNE DISEASES | NUEVOLUTION AS (DK) | 2022-02-23 | — | — | EP | disclosed |
| US-10889544-B2 | Ionic liquids comprising heteraromatic anions | UNIVERSITY OF NOTRE DAME DU LAC (US) | 2021-01-12 | — | — | US | disclosed |
| US-20190031608-A1 | IONIC LIQUIDS COMPRISING HETERAROMATIC ANIONS | UNITED STATES DEPARTMENT OF ENERGY | 2019-01-31 | — | — | US | disclosed |