⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21023565 | 0.71 | IRAK4 (0.31) | — | |
| SCHEMBL21606227 | 0.67 | GPR88 (0.34) | — | |
| SCHEMBL12315743 | 0.66 | HDAC3 (0.33) | — | |
| SCHEMBL27021613 | 0.66 | MAOB (0.33) | — | |
| SCHEMBL20350165 | 0.66 | HDAC3 (0.33) | — | |
| SCHEMBL13593980 | 0.66 | MAOB (0.33) | — | |
| SCHEMBL25854704 | 0.66 | EPHX2 (0.41) | — | |
| SCHEMBL25684730 | 0.66 | TSHR (0.31) | — | |
| SCHEMBL12920576 | 0.64 | MAPT (0.33) | — | |
| SCHEMBL13414989 | 0.64 | CTSS (0.31) | — |
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-20240238423-A9 | TETRAHYDROISOQUINOLINE HETEROBIFUNCTIONAL BCL-XL DEGRADERS | Treeline Biosciences, Inc. | 2024-07-18 | — | — | US | disclosed |