⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1824346 | 1.00 | — | — | |
| SCHEMBL6734957 | 1.00 | — | — | |
| SCHEMBL3492014 | 1.00 | — | — | |
| SCHEMBL3492010 | 1.00 | — | — | |
| SCHEMBL22160590 | 0.81 | GABRR1 (0.43) | — | |
| SCHEMBL6335676 | 0.81 | GABRR1 (0.43) | — | |
| SCHEMBL4445650 | 0.81 | GABRR1 (0.43) | — | |
| SCHEMBL2811192 | 0.81 | GABRR1 (0.43) | — | |
| SCHEMBL13221050 | 0.81 | GABRR1 (0.43) | — | |
| SCHEMBL17340414 | 0.80 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006099170-A2 | BETA-POLYPEPTIDES THAT INHIBIT CYTOMEGALOVIRUS INFECTION | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2006-09-21 | — | — | WO | disclosed |