⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1315547 | 1.00 | — | — | |
| SCHEMBL1112364 | 0.95 | — | — | |
| SCHEMBL1112034 | 0.95 | — | — | |
| SCHEMBL1112362 | 0.95 | — | — | |
| SCHEMBL8381801 | 0.95 | — | — | |
| SCHEMBL1112032 | 0.95 | — | — | |
| SCHEMBL1112367 | 0.95 | — | — | |
| SCHEMBL1112036 | 0.95 | — | — | |
| SCHEMBL8381800 | 0.95 | — | — | |
| SCHEMBL1112581 | 0.91 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-11080182-A | — | — | None | — | — | JP | disclosed |
| CN-102171225-B | The method of alkyl phosphonic acid, phosphonate ester and alkyl phosphonate is prepared in oxidation by means of phostonic acid, and their purposes | CLARIANT FINANCE (BVI) LTD. (VG) | 2015-09-09 | — | — | CN | disclosed |
| CN-102177164-B | Method for producing dialkylphosphinic acids and esters and salts thereof by means of allyl alcohols/acroleins and use thereof | CLARIANT FINANCE BVI LTD | 2015-02-11 | — | — | CN | disclosed |
| CN-102171227-B | Method for producing mono-carboxy-functionalized dialkylphosphinic acids, esters and salts using a vinyl ester of a carboxylic acid and the use thereof | CLARIANT INT LTD | 2014-11-12 | — | — | CN | disclosed |
| CN-102171224-B | Method for producing mono-carboxy-functionalized dialkylphosphinic acids, esters and salts using a vinyl ether and the use thereof | CLARIANT INT LTD | 2014-11-12 | — | — | CN | disclosed |
| CN-102164932-B | Process for preparing mono-carboxy-functionalized dialkylphosphinic acids, esters and salts by means of alkylene oxides and use thereof | CLARIANT FINANCE (BVI) LTD. (VG) | 2014-10-29 | — | — | CN | disclosed |
| EP-2352737-A1 | METHOD FOR PRODUCING DIALKYLPHOSPHINIC ACIDS AND ESTERS AND SALTS THEREOF BY MEANS OF VINYL COMPOUNDS AND USE THEREOF | Clariant International Ltd. (CH) | 2011-08-10 | — | — | EP | disclosed |
| WO-2010051887-A1 | METHOD FOR PRODUCING DIALKYLPHOSPHINIC ACIDS AND ESTERS AND SALTS THEREOF BY MEANS OF VINYL COMPOUNDS AND USE THEREOF | CLARIANT INTERNATIONAL LTD (CH) | 2010-05-14 | — | — | WO | disclosed |
| JP-H1180182-A | OXARUTHENA CYCLE COMPLEX AND ITS PRODUCTION | SUMITOMO CHEM CO LTD | 1999-03-26 | — | — | JP | disclosed |