⚠ 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 | |
|---|---|---|---|---|
| Benzene SCHEMBL4334380 | 0.78 | — | — | |
| SCHEMBL30194018 | 0.71 | LMNA (0.31) | — | |
| SCHEMBL3176852 | 0.71 | LMNA (0.38) | — | |
| SCHEMBL7936584 | 0.71 | LMNA (0.38) | — | |
| SCHEMBL6328126 | 0.71 | LMNA (0.38) | — | |
| SCHEMBL29634589 | 0.70 | — | — | |
| SCHEMBL30732885 | 0.70 | — | — | |
| SCHEMBL27096220 | 0.70 | — | — | |
| SCHEMBL724422 | 0.69 | — | — | |
| SCHEMBL1096254 | 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 |
|---|---|---|---|---|---|---|---|
| US-7612166-B2 | Fluorous capping reagents and methods for peptide purification | TRUSTEES OF TUFTS COLLEGE (US) | 2009-11-03 | — | — | US | disclosed |
| US-20080275216-A1 | Fluorous Capping Reagents and Methods for Peptide Purification | TRUSTEES OF TUFTS COLLEGE (US) | 2008-11-06 | — | — | US | disclosed |
| WO-2005118527-A2 | FLUOROUS CAPPING REAGENTS, AND METHODS FOR PEPTIDE PURIFICATION | TRUSTEES OF TUFTS COLLEGE (US) | 2005-12-15 | — | — | WO | disclosed |