⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18355773 | 0.77 | — | — | |
| SCHEMBL19115925 | 0.69 | — | — | |
| SCHEMBL12866005 | 0.64 | — | — | |
| SCHEMBL3484998 | 0.64 | — | — | |
| SCHEMBL11933941 | 0.61 | — | — | |
| SCHEMBL13877931 | 0.61 | — | — | |
| SCHEMBL14404769 | 0.58 | — | — | |
| SCHEMBL18500113 | 0.58 | — | — | |
| SCHEMBL18361674 | 0.58 | — | — | |
| SCHEMBL12308048 | 0.56 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7838466-B2 | Device for chemical and biochemical reactions using photo-generated reagents | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2010-11-23 | — | — | US | disclosed |
| US-20090124690-A1 | Generation of Combinatorial Synthetic Libraries and Screening for Novel Proadhesins and Nonadhesins | CERNOFINA, LLC | 2009-05-14 | — | — | US | disclosed |
| US-7491680-B2 | Device for chemical and biochemical reactions using photo-generated reagents | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2009-02-17 | — | — | US | disclosed |
| US-7479571-B2 | Generation of combinatorial synthetic libraries and screening for novel proadhesins and nonadhesins | CERNOFINA, LLC (US) | 2009-01-20 | — | — | US | disclosed |