⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4196069 | 0.75 | ALDH1A1 (0.37) | — | |
| SCHEMBL5933335 | 0.73 | — | — | |
| SCHEMBL5316495 | 0.73 | — | — | |
| SCHEMBL35307 | 0.73 | — | — | |
| SCHEMBL10386007 | 0.73 | — | — | |
| SCHEMBL1250524 | 0.71 | — | — | |
| SCHEMBL5932989 | 0.71 | — | — | |
| SCHEMBL5932979 | 0.71 | — | — | |
| SCHEMBL9843423 | 0.71 | — | — | |
| Trimethylammonium SCHEMBL28475756 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1501846-B1 | TRICYCLIC MACROLIDE ANTIBACTERIAL COMPOUNDS | ABBOTT LAB (US) | 2009-03-18 | — | — | EP | disclosed |
| US-6992069-B2 | Tricyclic macrolide antibacterial compounds | ABBVIE INC. | 2006-01-31 | — | — | US | disclosed |
| US-20040029818-A1 | Tricyclic macrolide antibacterial compounds | ABBVIE INC. | 2004-02-12 | — | — | US | disclosed |
| US-4038311-A | PRODUCTION OF N-(1-ALKENYL)-CARBAMYL CHLORIDES | BASF AKTIENGESELLSCHAFT (DT) | 1977-07-26 | — | — | US | disclosed |