⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6845221 | 0.88 | — | — | |
| SCHEMBL10860295 | 0.84 | CARM1 (0.39) | — | |
| Hydrochloric Acid SCHEMBL14660103 | 0.84 | KDM4E (0.42) | — | |
| SCHEMBL11615777 | 0.79 | — | — | |
| SCHEMBL14716928 | 0.78 | CARM1 (0.47) | — | |
| SCHEMBL5425 | 0.78 | — | — | |
| SCHEMBL20477518 | 0.76 | EPHX1 (0.55) | — | |
| Iodide SCHEMBL7118709 | 0.74 | — | — | |
| Ammonia Solution, Strong SCHEMBL2487756 | 0.74 | — | — | |
| Ammonia Solution, Strong SCHEMBL734851 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3888685-A1 | DRUG CONTAINING LIVER TARGETING SPECIFIC LIGAND AND THYROID HORMONE RECEPTOR AGONIST | Kylonova (Xiamen) Biopharma Co., Ltd. (CN) | 2021-10-06 | — | — | EP | disclosed |
| WO-2021143822-A1 | BICYCLIC IMIDE DERIVATIVE, PREPARATION METHOD THEREOF, AND APPLICATION THEREOF IN MEDICINE | 江苏恒瑞医药股份有限公司 | 2021-07-22 | — | — | WO | disclosed |