⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7643011 | 0.69 | LMNA (0.42) | — | |
| SCHEMBL7641162 | 0.69 | LMNA (0.42) | — | |
| SCHEMBL3482437 | 0.69 | — | — | |
| SCHEMBL1225739 | 0.68 | — | — | |
| SCHEMBL24871088 | 0.68 | LMNA (0.33) | — | |
| SCHEMBL13897046 | 0.68 | LMNA (0.33) | — | |
| SCHEMBL25620489 | 0.68 | LMNA (0.33) | — | |
| SCHEMBL3058414 | 0.67 | LMNA (0.37) | — | |
| SCHEMBL3482300 | 0.66 | TSHR (0.32) | — | |
| SCHEMBL25620457 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0907625-A4 | FLUOROUS REACTION AND SEPARATION SYSTEMS | UNIV PITTSBURGH (US) | 2004-10-20 | — | — | EP | disclosed |
| EP-0907625-A1 | FLUOROUS REACTION AND SEPARATION SYSTEMS | UNIVERSITY OF PITTSBURGH (US) | 1999-04-14 | — | — | EP | disclosed |
| WO-1998000376-A1 | FLUOROUS REACTION AND SEPARATION SYSTEMS | UNIVERSITY OF PITTSBURGH (US) | 1998-01-08 | — | — | WO | disclosed |