⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11759178 | 1.00 | — | — | |
| SCHEMBL14464900 | 0.75 | — | — | |
| SCHEMBL8089899 | 0.72 | — | — | |
| SCHEMBL27949563 | 0.72 | TSHR (0.31) | — | |
| SCHEMBL14495953 | 0.72 | ALDH1A1 (0.35) | — | |
| SCHEMBL19852572 | 0.71 | — | — | |
| SCHEMBL25704331 | 0.71 | ALDH1A1 (0.32) | — | |
| SCHEMBL68505 | 0.69 | — | — | |
| SCHEMBL805855 | 0.69 | — | — | |
| SCHEMBL5494935 | 0.69 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0027906-B1 | PROCESS FOR PREPARING SULPHON AMIDES | BAYER AG (DE) | 1983-05-25 | — | — | EP | disclosed |
| EP-0027906-A1 | Process for preparing sulphon amides | BAYER AG (DE) | 1981-05-06 | — | — | EP | disclosed |
| US-4060549-A | Process for preparing sulfonic acid fluorides | BAYER AKTIENGESELLSCHAFT (DT) | 1977-11-29 | — | — | US | disclosed |