⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20743841 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL20743682 | 0.80 | — | — | |
| SCHEMBL11979484 | 0.78 | CYP2C19 (0.33) | — | |
| SCHEMBL22345263 | 0.74 | CYP2C19 (0.33) | — | |
| Hydrochloric Acid SCHEMBL27648927 | 0.74 | CA1 (0.37) | — | |
| SCHEMBL2989722 | 0.74 | — | — | |
| SCHEMBL22345242 | 0.73 | — | — | |
| SCHEMBL29095929 | 0.72 | CYP2C19 (0.36) | — | |
| SCHEMBL20744326 | 0.71 | CA12 (0.35) | — | |
| SCHEMBL23881700 | 0.71 | ATR (0.34) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2609426-B1 | FLUORESCENCE LABELING REAGENTS AND USES THEREOF | TEXAS A & M UNIV SYS (US) | 2018-12-19 | — | — | EP | disclosed |
| US-9896522-B2 | Solid phase fluorescence labeling reagents and uses thereof | THE TEXAS A&M UNIVERSITY SYSTEM (US) | 2018-02-20 | — | — | US | disclosed |
| US-9896522-B2 | Solid phase fluorescence labeling reagents and uses thereof | THE TEXAS A&M UNIVERSITY SYSTEM (US) | 2018-02-20 | — | — | US | disclosed |
| US-9896522-B2 | Solid phase fluorescence labeling reagents and uses thereof | THE TEXAS A&M UNIVERSITY SYSTEM (US) | 2018-02-20 | — | — | US | disclosed |
| US-20130224870-A1 | FLUORESCENCE LABELING REAGENTS AND USES THEREOF | THE TEXAS A&M UNIVERSITY SYSTEM (US) | 2013-08-29 | — | — | US | disclosed |
| US-20130224870-A1 | FLUORESCENCE LABELING REAGENTS AND USES THEREOF | THE TEXAS A&M UNIVERSITY SYSTEM (US) | 2013-08-29 | — | — | US | disclosed |
| US-20130224870-A1 | FLUORESCENCE LABELING REAGENTS AND USES THEREOF | THE TEXAS A&M UNIVERSITY SYSTEM (US) | 2013-08-29 | — | — | US | disclosed |
| EP-2609426-A2 | FLOURESCENCE LABELING REAGENTS AND USES THEREOF | The Texas A&M University System (US) | 2013-07-03 | — | — | EP | disclosed |
| WO-2012027717-A2 | FLOURESCENCE LABELING REAGENTS AND USES THEREOF | THE TEXAS A&M UNIVERSITY SYSTEM (US) | 2012-03-01 | — | — | WO | disclosed |