⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6364242 | 0.84 | XIAP (0.33) | — | |
| SCHEMBL6364988 | 0.71 | XIAP (0.33) | — | |
| Hydrochloric Acid SCHEMBL6305086 | 0.70 | XIAP (0.33) | — | |
| Hydrochloric Acid SCHEMBL7424704 | 0.70 | XIAP (0.33) | — | |
| SCHEMBL7427846 | 0.68 | PIK3CD (0.33) | — | |
| Hydrochloric Acid SCHEMBL6309974 | 0.67 | PIK3CD (0.33) | — | |
| Hydrochloric Acid SCHEMBL7429831 | 0.67 | PIK3CD (0.33) | — | |
| SCHEMBL7425403 | 0.59 | XIAP (0.33) | — | |
| SCHEMBL8330682 | 0.51 | TAAR1 (0.37) | — | |
| SCHEMBL18675293 | 0.49 | CCR2 (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023164171-A2 | MULTILAYER IMPLANTABLE CELL ENCAPSULATION DEVICES AND METHODS THEREOF | VIACYTE, INC. (US) | 2023-08-31 | — | — | WO | disclosed |
| WO-2018129046-A1 | COMPOSITIONS AND METHODS FOR MODULATING CILIOGENESIS | UNIVERSITY OF PITTSBURGH- OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2018-07-12 | — | — | WO | disclosed |
| EP-2970899-A1 | IN VITRO DIFFERENTIATION OF PLURIPOTENT STEM CELLS TO PANCREATIC ENDODERM CELLS (PEC) AND ENDOCRINE CELLS | ViaCyte, Inc. (US) | 2016-01-20 | — | — | EP | disclosed |
| WO-2014160413-A1 | IN VITRO DIFFERENTIATION OF PLURIPOTENT STEM CELLS TO PANCREATIC ENDODERM CELLS (PEC) AND ENDOCRINE CELLS | VIACYTE, INC. (US) | 2014-10-02 | — | — | WO | disclosed |