⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4525241 | 0.85 | — | — | |
| SCHEMBL7260643 | 0.85 | — | — | |
| SCHEMBL3287612 | 0.85 | — | — | |
| SCHEMBL3292221 | 0.85 | — | — | |
| SCHEMBL7260623 | 0.84 | — | — | |
| SCHEMBL3289310 | 0.81 | DRD2 (0.30) | — | |
| SCHEMBL3293797 | 0.79 | SLC6A5 (0.33) | — | |
| SCHEMBL3288250 | 0.79 | — | — | |
| SCHEMBL3295251 | 0.74 | EPHX2 (0.31) | — | |
| SCHEMBL3294062 | 0.73 | SIRT2 (0.43) | — |
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-7531676-B2 | Lipids | CELLTECH R & D LIMITED (GB) | 2009-05-12 | — | — | US | disclosed |
| US-20060148761-A1 | Lipids | CELLTECH R & D LIMITED | 2006-07-06 | — | — | US | disclosed |
| US-20040024220-A1 | Lipids | CELLTECH R & D LIMITED | 2004-02-05 | — | — | US | disclosed |
| US-6583301-B1 | Bipolar; form complexes with polyanions; delivering bioactive substances such as nucleic acids to cells in vitro and in vivo | CELLTECH R & D LIMITED (GB) | 2003-06-24 | — | — | US | disclosed |