⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21885679 | 0.77 | — | — | |
| SCHEMBL20026331 | 0.76 | — | — | |
| SCHEMBL17623091 | 0.68 | — | — | |
| SCHEMBL21888973 | 0.67 | — | — | |
| SCHEMBL2632819 | 0.67 | — | — | |
| Iodide SCHEMBL17611123 | 0.67 | NOS3 (0.31) | — | |
| SCHEMBL13049139 | 0.65 | — | — | |
| Iodide SCHEMBL11583158 | 0.65 | HDAC3 (0.40) | — | |
| SCHEMBL14029059 | 0.63 | NISCH (0.41) | — | |
| SCHEMBL8344503 | 0.62 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11091483-B2 | Protein kinase regulators | Madera Therapeutics, LLC (US) | 2021-08-17 | — | — | US | disclosed |
| US-10968185-B2 | Substituted thiazoles for preventing and/or treating cell or tissue necrosis | ELA PHARMA LTD. (IL) | 2021-04-06 | — | — | US | disclosed |
| US-20190177323-A1 | Protein Kinase Regulators | Madera Therapeutics, LLC | 2019-06-13 | — | — | US | disclosed |