⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27794325 | 0.95 | — | — | |
| SCHEMBL7636286 | 0.95 | — | — | |
| SCHEMBL379098 | 0.95 | — | — | |
| SCHEMBL18045212 | 0.95 | — | — | |
| Water SCHEMBL1014182 | 0.95 | — | — | |
| Water SCHEMBL717161 | 0.95 | — | — | |
| SCHEMBL11674568 | 0.95 | — | — | |
| SCHEMBL15260526 | 0.95 | — | — | |
| Water SCHEMBL717160 | 0.95 | — | — | |
| Water SCHEMBL718583 | 0.95 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105566301-A | Topiroxostat preparation technology | SHANDONG LUOXIN PHARMACEUTICAL GROUP CO LTD | 2016-05-11 | — | — | CN | claimed |
| CN-102675151-B | Preparation method of nitrophenylacetonitrile compound | BEIJING YINGTAI JIAHE BIOLOG TECHNOLOGY CO LTD | 2014-02-19 | — | — | CN | claimed |
| CN-102675151-A | Preparation method of nitrophenylacetonitrile compound | BEIJING YINGTAI JIAHE BIOLOG TECHNOLOGY CO LTD | 2012-09-19 | — | — | CN | claimed |
| CN-101671300-B | Method for preparing 2-cyano-3, 6-dichloropyridine | NANJING NO 1 PESTICIDE GROUP CO LTD | 2011-04-13 | — | — | CN | claimed |
| CN-101671300-A | Method for preparing 2-cyano-3, 6-dichloropyridine | NANJING NO 1 PESTICIDE GROUP C | 2010-03-17 | — | — | CN | claimed |
| CN-101602721-A | A kind of 2-cyano group-3, the synthetic method of 6-dichloropyridine | FIRST PESTICIDE GROUP CO LTD (CN) | 2009-12-16 | — | — | CN | claimed |
| CN-105566301-A | Topiroxostat preparation technology | SHANDONG LUOXIN PHARMACEUTICAL GROUP CO LTD | 2016-05-11 | — | — | CN | disclosed |
| CN-102675151-B | Preparation method of nitrophenylacetonitrile compound | BEIJING YINGTAI JIAHE BIOLOG TECHNOLOGY CO LTD | 2014-02-19 | — | — | CN | disclosed |
| CN-101679320-B | Process for preparing triazolones | HOFFMANN LA ROCHE | 2013-01-23 | — | — | CN | disclosed |
| CN-102675151-A | Preparation method of nitrophenylacetonitrile compound | BEIJING YINGTAI JIAHE BIOLOG TECHNOLOGY CO LTD | 2012-09-19 | — | — | CN | disclosed |
| CN-101671300-B | Method for preparing 2-cyano-3, 6-dichloropyridine | NANJING NO 1 PESTICIDE GROUP CO LTD | 2011-04-13 | — | — | CN | disclosed |
| CN-101679320-A | Process for preparing triazolones | HOFFMANN LA ROCHE | 2010-03-24 | — | — | CN | disclosed |
| CN-101671300-A | Method for preparing 2-cyano-3, 6-dichloropyridine | NANJING NO 1 PESTICIDE GROUP C | 2010-03-17 | — | — | CN | disclosed |
| CN-101602721-A | A kind of 2-cyano group-3, the synthetic method of 6-dichloropyridine | FIRST PESTICIDE GROUP CO LTD (CN) | 2009-12-16 | — | — | CN | disclosed |