⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19245403 | 1.00 | — | — | |
| SCHEMBL15834073 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL28241322 | 0.97 | USP2 (0.36) | — | |
| SCHEMBL10296126 | 0.80 | USP2 (0.34) | — | |
| SCHEMBL25719293 | 0.80 | HDAC7 (0.43) | — | |
| SCHEMBL13227770 | 0.80 | HDAC7 (0.43) | — | |
| SCHEMBL19993047 | 0.79 | — | — | |
| SCHEMBL15765660 | 0.79 | — | — | |
| SCHEMBL14588571 | 0.78 | ALDH1A1 (0.38) | — | |
| SCHEMBL15159359 | 0.78 | KDM4E (0.43) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023006097-A1 | BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUND AND USE THEREOF AS ANDROGEN RECEPTOR DEGRADER | 海创药业股份有限公司 | 2023-02-02 | — | — | WO | disclosed |
| US-20210198203-A1 | COMPOUNDS, COMPOSITIONS AND METHODS | CYTOKINETICS, INCORPORATED | 2021-07-01 | — | — | US | disclosed |
| WO-2020029980-A1 | SMAD3 INHIBITORS | MOEXA PHARMACEUTICALS LIMITED (CN) | 2020-02-13 | — | — | WO | disclosed |
| US-8828433-B2 | Hydrogel bioscaffoldings and biomedical device coatings | ADVANCED CARDIOVASCULAR SYSTEMS, INC. (US) | 2014-09-09 | — | — | US | disclosed |
| US-8513257-B2 | Ureas and their use in the treatment of heart failure | CYTOKINETICS, INCORPORATED (US) | 2013-08-20 | — | — | US | disclosed |
| EP-2471363-A1 | Use of aryl-, heteroaryl- and benzylsulfonamide carboxylic acids, -carboxylic acid esters, -carboxylic acid amides and -carbonitriles and/or its salts for increasing stress tolerance in plants | Bayer CropScience AG (DE) | 2012-07-04 | — | — | EP | disclosed |