⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10794757 | 0.94 | — | — | |
| SCHEMBL8916177 | 0.91 | — | — | |
| SCHEMBL19973154 | 0.91 | — | — | |
| SCHEMBL7203109 | 0.87 | — | — | |
| SCHEMBL20912173 | 0.83 | — | — | |
| SCHEMBL21782076 | 0.75 | — | — | |
| SCHEMBL28818185 | 0.71 | — | — | |
| SCHEMBL28854629 | 0.70 | — | — | |
| SCHEMBL28875927 | 0.70 | — | — | |
| SCHEMBL2794472 | 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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112125833-B | Bola type surfactant with self-demulsification capacity and preparation method and application thereof | 陕西科技大学 | 2022-02-25 | — | — | CN | disclosed |
| CN-112125833-A | Bola type surfactant with self-demulsification capacity and preparation method and application thereof | 陕西科技大学 | 2020-12-25 | — | — | CN | disclosed |
| CN-112110844-A | Chelating agent and preparation method thereof | 陕西科技大学 | 2020-12-22 | — | — | CN | disclosed |
| CN-107683130-A | Implant and application method including oxygen sterol | 华沙整形外科股份有限公司 | 2018-02-09 | — | — | CN | disclosed |
| EP-2841435-B1 | PYRROLOPYRIDINONE DERIVATIVES AS TTX-S BLOCKERS | RAQUALIA PHARMA INC (JP) | 2017-09-06 | — | — | EP | disclosed |
| CN-106800580-A | Sterol derivative and preparation method and application thereof | 中国药科大学 | 2017-06-06 | — | — | CN | disclosed |