⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14868744 | 0.76 | — | — | |
| SCHEMBL15100766 | 0.70 | — | — | |
| SCHEMBL28320299 | 0.70 | — | — | |
| SCHEMBL1060673 | 0.67 | — | — | |
| SCHEMBL8255846 | 0.65 | — | — | |
| SCHEMBL14868804 | 0.64 | KDM4E (0.40) | — | |
| SCHEMBL4650714 | 0.64 | — | — | |
| SCHEMBL19077865 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL23088182 | 0.62 | — | — | |
| SCHEMBL21547816 | 0.58 | PDK2 (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023154314-A1 | SPIRO PIPERIDINE DERIVATIVES AS INHIBITORS OF APOL1 AND METHODS OF USING SAME | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2023-08-17 | — | — | WO | disclosed |