⚠ 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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL502182 | 0.97 | — | — | |
| Benzene SCHEMBL2937772 | 0.97 | GRM5 (0.48) | — | |
| SCHEMBL19540310 | 0.97 | GRM5 (0.48) | — | |
| Benzene SCHEMBL27712261 | 0.94 | GRM5 (0.47) | — | |
| SCHEMBL4733426 | 0.94 | KDM4E (0.50) | — | |
| SCHEMBL16322907 | 0.94 | KDM4E (0.50) | — | |
| SCHEMBL29472848 | 0.94 | — | — | |
| SCHEMBL29599136 | 0.94 | KDM4E (0.50) | — | |
| SCHEMBL2684 | 0.94 | — | — | |
| Bicarbonate SCHEMBL28275045 | 0.93 | LMNA (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0224662-B1 | PROCESS FOR THE PREPARATION OF OXIDES OF AROMATIC TERTIARY AMINES, AND PRODUCTS SO OBTAINED | INTEROX Société Anonyme (BE) | 1991-12-18 | — | — | EP | claimed |
| CN-105170141-B | A kind of nano aluminum platinum catalyst and its application | 安徽星宇化工有限公司 | 2018-09-25 | — | — | CN | disclosed |
| CN-105170142-B | A kind of nano aluminum platinum catalyst and its preparation method and application | 安徽星宇化工有限公司 | 2017-10-31 | — | — | CN | disclosed |
| CN-103908961-B | Preparation method of 2-pyridinemethanol | ANHUI XINGYU CHEMICAL Co.,Ltd. (CN) | 2016-01-20 | — | — | CN | disclosed |
| CN-105170141-A | Nano aluminum-platinum catalyst and applications thereof | ANHUI XINGYU CHEMICAL CO LTD | 2015-12-23 | — | — | CN | disclosed |
| CN-105170142-A | Nano aluminum-platinum catalyst, preparation method and applications thereof | ANHUI XINGYU CHEMICAL CO LTD | 2015-12-23 | — | — | CN | disclosed |
| CN-103908961-A | Nano aluminum platinum catalyst, preparation method and application thereof, and preparation method of 2-pyridinemethanol | ANHUI XINGYU CHEMICAL CO LTD | 2014-07-09 | — | — | CN | disclosed |