⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23957778 | 0.74 | — | — | |
| SCHEMBL555474 | 0.74 | — | — | |
| SCHEMBL28386734 | 0.72 | — | — | |
| SCHEMBL14762098 | 0.69 | CA2 (0.42) | — | |
| SCHEMBL1935391 | 0.69 | CA2 (0.42) | — | |
| SCHEMBL2053132 | 0.65 | CA2 (0.59) | — | |
| SCHEMBL2884635 | 0.65 | CA2 (0.59) | — | |
| SCHEMBL877811 | 0.63 | — | — | |
| SCHEMBL6488162 | 0.63 | — | — | |
| SCHEMBL6036957 | 0.63 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112010835-A | Carbon-sulfur-containing dual-chiral sulfimide and sulfimide derivatives, and preparation and application thereof | 南开大学 | 2020-12-01 | — | — | CN | claimed |
| CN-105315277-A | Chiral bisamide derivatives and preparation and application thereof | UNIV NANKAI | 2016-02-10 | — | — | CN | claimed |
| CN-112010835-A | Carbon-sulfur-containing dual-chiral sulfimide and sulfimide derivatives, and preparation and application thereof | 南开大学 | 2020-12-01 | — | — | CN | disclosed |
| CN-105315277-A | Chiral bisamide derivatives and preparation and application thereof | UNIV NANKAI | 2016-02-10 | — | — | CN | disclosed |
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |