⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1270359 | 0.81 | TSHR (0.41) | — | |
| SCHEMBL17733018 | 0.71 | — | — | |
| SCHEMBL20054191 | 0.70 | TP53 (0.32) | — | |
| SCHEMBL21095874 | 0.69 | CHRNB2 (0.36) | — | |
| SCHEMBL19245751 | 0.69 | — | — | |
| SCHEMBL14495737 | 0.69 | TSHR (0.36) | — | |
| SCHEMBL513994 | 0.67 | — | — | |
| SCHEMBL9129884 | 0.67 | — | — | |
| SCHEMBL11103446 | 0.67 | LMNA (0.42) | — | |
| SCHEMBL12166831 | 0.67 | TP53 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230065740-A1 | CYCLIN-DEPENDENT KINASE INHIBITORS | SPV THERAPEUTICS INC. | 2023-03-02 | — | — | US | disclosed |