⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6139635 | 0.98 | — | — | |
| SCHEMBL4391933 | 0.89 | — | — | |
| SCHEMBL8854144 | 0.86 | LMNA (0.33) | — | |
| SCHEMBL8071570 | 0.86 | LMNA (0.33) | — | |
| SCHEMBL28728864 | 0.81 | — | — | |
| SCHEMBL4784789 | 0.79 | — | — | |
| SCHEMBL8902431 | 0.78 | — | — | |
| SCHEMBL12288828 | 0.78 | TSHR (0.43) | — | |
| SCHEMBL19990369 | 0.78 | — | — | |
| SCHEMBL25305084 | 0.77 | — | — |
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-1999003509-A2 | PHARMACEUTICAL PRODUCTS CONTAINING TRIIODOAROMATS CONTAINING PERFLUOROALKYL GROUPS, AND THE USE THEREOF IN THE TREATMENT OF TUMOURS AND INTERVENTIONAL RADIOLOGY | SCHERING AKTIENGESELLSCHAFT (DE) | 1999-01-28 | — | — | WO | disclosed |