⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25024 | 0.67 | — | — | |
| SCHEMBL20523530 | 0.67 | — | — | |
| SCHEMBL1547914 | 0.63 | — | — | |
| SCHEMBL3492820 | 0.61 | — | — | |
| SCHEMBL8104075 | 0.61 | — | — | |
| SCHEMBL3055659 | 0.59 | — | — | |
| SCHEMBL4353653 | 0.59 | — | — | |
| SCHEMBL8445416 | 0.59 | — | — | |
| SCHEMBL16289615 | 0.57 | — | — | |
| SCHEMBL128803 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7745229-B2 | Chemoselective fluorgenic molecular linkers and methods for their preparation and use | UNIVERSITY OF SOUTH CAROLINA | 2010-06-29 | — | — | US | disclosed |
| US-20070224695-A1 | Chemoselective Fluorgenic Molecular Linkers and Methods for Their Preparation and Use | UNIVERSITY OF SOUTH CAROLINA (US) | 2007-09-27 | — | — | US | disclosed |
| WO-2005103705-A2 | CHEMOSELECTIVE FLUOROGENIC MOLECULAR LINKERS AND METHODS OF THEIR PREPARATION AND USE | UNIVERSITY OF SOUTH CAROLINA (US) | 2005-11-03 | — | — | WO | disclosed |