⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17309054 | 0.77 | — | — | |
| Iodide SCHEMBL10856313 | 0.61 | — | — | |
| SCHEMBL818957 | 0.57 | — | — | |
| SCHEMBL14612064 | 0.57 | — | — | |
| SCHEMBL13233500 | 0.54 | TSHR (0.38) | — | |
| SCHEMBL3555788 | 0.54 | — | — | |
| SCHEMBL5709556 | 0.53 | — | — | |
| SCHEMBL13074412 | 0.52 | TSHR (0.58) | — | |
| SCHEMBL6036786 | 0.52 | — | — | |
| SCHEMBL12809719 | 0.52 | TSHR (0.58) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10718778-B2 | Compositions and methods for detecting protein sulfenylation | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2020-07-21 | — | — | US | disclosed |
| US-20170192010-A1 | COMPOSITIONS AND METHODS FOR DETECTING PROTEIN SULFENYLATION | THE REGENTS OF THE UNIVERSITY OF MICHIGAN | 2017-07-06 | — | — | US | disclosed |
| US-20170192010-A1 | COMPOSITIONS AND METHODS FOR DETECTING PROTEIN SULFENYLATION | THE REGENTS OF THE UNIVERSITY OF MICHIGAN | 2017-07-06 | — | — | US | disclosed |
| WO-2015184281-A2 | COMPOSITIONS AND METHODS FOR DETECTING PROTEIN SULFENYLATION | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2015-12-03 | — | — | WO | disclosed |