⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15674186 | 0.97 | — | — | |
| SCHEMBL12164293 | 0.97 | — | — | |
| SCHEMBL8895269 | 0.85 | CA5A (0.36) | — | |
| SCHEMBL3113903 | 0.85 | CA5A (0.36) | — | |
| SCHEMBL1311968 | 0.76 | ALDH1A1 (0.32) | — | |
| Methane SCHEMBL28555090 | 0.74 | — | — | |
| SCHEMBL1326779 | 0.74 | — | — | |
| SCHEMBL9208162 | 0.73 | CA2 (0.37) | — | |
| SCHEMBL9230504 | 0.72 | — | — | |
| SCHEMBL9935973 | 0.72 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7625878-B2 | Sulfoalkyl ether-alkyl ether cyclodextrin derivatives | THE UNIVERSITY OF KANSAS (US) | 2009-12-01 | — | — | US | disclosed |
| EP-1678211-A4 | SULFOALKYL ETHER-ALKYL ETHER CYCLODEXTRIN DERIVATIVES | UNIV KANSAS (US) | 2008-04-02 | — | — | EP | disclosed |
| US-20060258537-A1 | Sulfoalkyl ether-alkyl ether cyclodextrin derivatives | UNIVERSITY OF KANSAS | 2006-11-16 | — | — | US | disclosed |
| EP-1678211-A2 | SULFOALKYL ETHER-ALKYL ETHER CYCLODEXTRIN DERIVATIVES | THE UNIVERSITY OF KANSAS (US) | 2006-07-12 | — | — | EP | disclosed |
| WO-2005042584-A2 | SULFOALKYL ETHER-ALKYL ETHER CYCLODEXTRIN DERIVATIVES | THE UNIVERSITY OF KANSAS (US) | 2005-05-12 | — | — | WO | disclosed |
| US-5567758-A | SULFONATED END GROUPS; EXCELLENT CRYSTALLIZATION | TOYO BOSEKI KABUSHIKI KAISHA (JP) | 1996-10-22 | — | — | US | disclosed |