⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27457152 | 0.87 | — | — | |
| SCHEMBL28039815 | 0.71 | — | — | |
| SCHEMBL11316785 | 0.69 | — | — | |
| SCHEMBL28047495 | 0.65 | — | — | |
| SCHEMBL27483988 | 0.65 | — | — | |
| SCHEMBL28047397 | 0.63 | — | — | |
| SCHEMBL27282487 | 0.63 | — | — | |
| SCHEMBL28047399 | 0.61 | — | — | |
| SCHEMBL7563212 | 0.60 | CXCR4 (0.33) | — | |
| SCHEMBL29142570 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101880211-A | Method for preparing sulfonyl ring thiourea from mono-sulfonyl diamine in aqueous phase | UNIV TIANJIN | 2010-11-10 | — | — | CN | disclosed |