⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11225330 | 0.69 | — | — | |
| SCHEMBL2114444 | 0.67 | — | — | |
| SCHEMBL765232 | 0.65 | — | — | |
| SCHEMBL28925178 | 0.60 | — | — | |
| SCHEMBL268204 | 0.60 | — | — | |
| SCHEMBL19068572 | 0.60 | — | — | |
| SCHEMBL13464398 | 0.60 | — | — | |
| SCHEMBL1289386 | 0.60 | — | — | |
| SCHEMBL2002964 | 0.57 | — | — | |
| Hydrochloric Acid SCHEMBL931074 | 0.57 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8552176-B2 | Glycosylated chlorambucil analogs and uses thereof | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2013-10-08 | — | — | US | disclosed |
| US-20120094946-A1 | GLYCOSYLATED CHLORAMBUCIL ANALOGS AND USES THEREOF | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2012-04-19 | — | — | US | disclosed |