⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12827193 | 1.00 | — | — | |
| SCHEMBL13804967 | 1.00 | — | — | |
| SCHEMBL12827025 | 1.00 | — | — | |
| SCHEMBL9008695 | 0.69 | — | — | |
| SCHEMBL545472 | 0.68 | — | — | |
| SCHEMBL6245016 | 0.67 | — | — | |
| SCHEMBL27604483 | 0.65 | — | — | |
| SCHEMBL19519614 | 0.65 | — | — | |
| SCHEMBL12747471 | 0.64 | FUCA1 (0.33) | — | |
| SCHEMBL1471438 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3347355-B1 | HETEROTRICYCLIC SULFONAMIDES AS ANTI-CANCER AGENTS | ICAHN SCHOOL MED MOUNT SINAI (US) | 2022-07-13 | — | — | EP | disclosed |