⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL369 | 1.00 | — | — | |
| Phosphine SCHEMBL18523707 | 0.89 | — | — | |
| Methane SCHEMBL11135122 | 0.89 | — | — | |
| SCHEMBL9308557 | 0.89 | — | — | |
| Fluoride SCHEMBL20854537 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL178238 | 0.89 | — | — | |
| SCHEMBL20854536 | 0.89 | — | — | |
| SCHEMBL31440793 | 0.89 | — | — | |
| SCHEMBL8373620 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL11665997 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108822864-A | One heavy metal species soil-repairing agent and preparation method thereof | 代彦霞 | 2018-11-16 | — | — | CN | claimed |
| CN-206430966-U | Measure the sample pretreatment apparatus of trace phosphorus impurity content in chlorosilane | 天津大学 | 2017-08-22 | — | — | CN | disclosed |
| CN-106644660-A | A sample pretreatment device and method for measuring the trace phosphorous impurity content in chlorosilane | 天津大学 | 2017-05-10 | — | — | CN | disclosed |
| EP-1586576-A1 | PROCESS FOR THE PRODUCTION OF PENTAERYTHRITOL DIPHOSPHONATES | Teijin Chemicals, Ltd. (JP) | 2005-10-19 | — | — | EP | disclosed |