⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4565293 | 0.67 | — | — | |
| SCHEMBL28284430 | 0.65 | — | — | |
| SCHEMBL8486835 | 0.65 | — | — | |
| SCHEMBL26596870 | 0.60 | HPGD (0.32) | — | |
| SCHEMBL15326678 | 0.58 | PTPN1 (0.35) | — | |
| SCHEMBL4414820 | 0.58 | MKNK1 (0.39) | — | |
| SCHEMBL27551614 | 0.58 | — | — | |
| SCHEMBL27869260 | 0.51 | — | — | |
| SCHEMBL4917339 | 0.49 | — | — | |
| SCHEMBL28230063 | 0.48 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109796439-A | A kind of hydroxyproline class peptide derivant and its preparation method and application | 西安交通大学 | 2019-05-24 | — | — | CN | claimed |
| CN-107814765-A | The preparation method of 2 (pyridylazo of 3,5 dibromo 2) 5 diethylaminophenols | 天津市化学试剂研究所有限公司 | 2018-03-20 | — | — | CN | claimed |
| CN-107814762-A | The preparation method of 4 (pyridylazo of 3,5 dibromo 2) 1,3 diaminobenzenes | 天津市化学试剂研究所有限公司 | 2018-03-20 | — | — | CN | claimed |
| CN-109824582-A | A kind of alanine derivatives and its preparation method and application | 西安交通大学 | 2019-05-31 | — | — | CN | disclosed |
| CN-105503731-B | 1- (2,6- dichlor-4-trifluoromethyls) phenyl -3- cyano group -5- methylenes amino-pyrazol type compound and its micro-wave digestion synthetic method and application | 中南民族大学 | 2018-05-15 | — | — | CN | disclosed |
| CN-107428750-A | TRIAZOLOPYRIDINE COMPOUNDS AND METHODS OF USE THEREOF | 豪夫迈·罗氏有限公司 | 2017-12-01 | — | — | CN | disclosed |
| CN-107266438-A | A kind of heterocyclic organic electroluminescent compounds and its organic electroluminescence device | 上海道亦化工科技有限公司 | 2017-10-20 | — | — | CN | disclosed |