⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL912064 | 1.00 | — | — | |
| Water SCHEMBL28059026 | 0.96 | — | — | |
| Phosphoric Acid SCHEMBL456720 | 0.96 | KDM4E (0.53) | — | |
| Phosphoric Acid SCHEMBL7566197 | 0.96 | KDM4E (0.53) | — | |
| Phosphoric Acid SCHEMBL9154089 | 0.96 | KDM4E (0.53) | — | |
| SCHEMBL27766663 | 0.96 | KDM4E (0.61) | — | |
| SCHEMBL35435 | 0.96 | — | — | |
| SCHEMBL4587636 | 0.92 | KDM4E (0.57) | — | |
| SCHEMBL3061460 | 0.92 | — | — | |
| SCHEMBL17626577 | 0.92 | KDM4E (0.57) | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103773629-A | Novel efficient cement scale cleaning fluid and preparation method thereof | ZHANG JIANJIA | 2014-05-07 | — | — | CN | claimed |
| CN-101023090-A | Prodrugs of HIV protease inhibitors | ABBOTT LAB (US) | 2007-08-22 | — | — | CN | claimed |
| CN-1255392-C | Colchicol derivatives as angiogenesis inhibitors | ANGIOGENE PHARM LTD (GB) | 2006-05-10 | — | — | CN | claimed |
| CN-1440396-A | Colchicol derivatives as angiogenesis inhibitors | ANGIOGENE PHARM LTD (GB) | 2003-09-03 | — | — | CN | claimed |
| CN-105814092-B | Composition for hydrophilic cured product | 三井化学株式会社 | 2018-09-21 | — | — | CN | 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 |
| US-9018413-B2 | Method for the production of alkylphosphonic acids, esters, and salts by oxidizing alkylphosphonous acids, and use thereof | CLARIANT FINANCE (BVI) LIMITED (VG) | 2015-04-28 | — | — | US | disclosed |
| CN-101023090-B | Prodrugs of HIV protease inhibitors | ABBOTT LAB | 2013-03-27 | — | — | CN | disclosed |
| US-20110251314-A1 | Method for the Production of Alkylphosphonic Acids, Esters, and Salts by Oxidizing Alkylphosphonous Acids, and Use Thereof | CLARIANT FINANCE (BVI) LIMITED (VG) | 2011-10-13 | — | — | US | disclosed |
| CN-102171225-A | Method for the production of alkylphosphonic acids, esters, and salts by oxidizing alkylphosphonous acids, and use thereof | CLARIANT INT LTD | 2011-08-31 | — | — | CN | disclosed |
| CN-101023090-A | Prodrugs of HIV protease inhibitors | ABBOTT LAB (US) | 2007-08-22 | — | — | CN | disclosed |
| CN-1255392-C | Colchicol derivatives as angiogenesis inhibitors | ANGIOGENE PHARM LTD (GB) | 2006-05-10 | — | — | CN | disclosed |
| CN-1440396-A | Colchicol derivatives as angiogenesis inhibitors | ANGIOGENE PHARM LTD (GB) | 2003-09-03 | — | — | CN | disclosed |