⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6652659 | 0.86 | — | — | |
| SCHEMBL3026296 | 0.77 | — | — | |
| SCHEMBL10352085 | 0.76 | ALDH1A1 (0.44) | — | |
| SCHEMBL2467893 | 0.75 | — | — | |
| SCHEMBL28985663 | 0.71 | — | — | |
| SCHEMBL4617751 | 0.70 | — | — | |
| SCHEMBL7159719 | 0.70 | — | — | |
| SCHEMBL11548934 | 0.70 | USP2 (0.39) | — | |
| SCHEMBL1978922 | 0.69 | ALDH1A1 (0.50) | — | |
| SCHEMBL1976212 | 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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1404687-B1 | FLUOROUS TRIPHASE AND OTHER MULTIPHASE SYSTEMS | UNIV PITTSBURGH (US) | 2006-12-27 | — | — | EP | disclosed |
| US-6897331-B2 | Fluorous triphase and other multiphase systems | UNIVERSITY OF PITTSBURGH (US) | 2005-05-24 | — | — | US | disclosed |
| EP-1404687-A4 | FLUOROUS TRIPHASE AND OTHER MULTIPHASE SYSTEMS | UNIV PITTSBURGH (US) | 2004-10-27 | — | — | EP | disclosed |
| EP-1404687-A2 | FLUOROUS TRIPHASE AND OTHER MULTIPHASE SYSTEMS | UNIVERSITY OF PITTSBURGH (US) | 2004-04-07 | — | — | EP | disclosed |
| US-20030125590-A1 | Fluorous triphase and other multiphase systems | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2003-07-03 | — | — | US | disclosed |
| WO-2002100802-A2 | FLUOROUS TRIPHASE AND OTHER MULTIPHASE SYSTEMS | UNIVERSITY OF PITTSBURGH (US) | 2002-12-19 | — | — | WO | disclosed |