⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL767094 | 0.74 | — | — | |
| SCHEMBL1110052 | 0.68 | CYP3A4 (0.35) | — | |
| SCHEMBL743279 | 0.67 | — | — | |
| SCHEMBL1006972 | 0.65 | — | — | |
| SCHEMBL27271974 | 0.65 | — | — | |
| SCHEMBL601184 | 0.62 | — | — | |
| SCHEMBL20792914 | 0.61 | — | — | |
| SCHEMBL13163597 | 0.59 | GAA (0.31) | — | |
| SCHEMBL3111535 | 0.58 | — | — | |
| SCHEMBL1760664 | 0.58 | — | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9648879-B2 | Co-crystal and method for producing same | NIPPON SODA CO., LTD. (JP) | 2017-05-16 | — | — | US | disclosed |
| US-20160278380-A1 | CO-CRYSTAL AND METHOD FOR PRODUCING SAME | NIPPON SODA CO., LTD. (JP) | 2016-09-29 | — | — | US | disclosed |
| EP-3069610-A1 | CO-CRYSTAL AND METHOD FOR PRODUCING SAME | Nippon Soda Co., Ltd. (JP) | 2016-09-21 | — | — | EP | disclosed |
| EP-2711361-B1 | NITROGENATED HETEROCYCLIC COMPOUND AND AGRICULTURAL OR HORTICULTURAL FUNGICIDE | NIPPON SODA CO (JP) | 2016-06-29 | — | — | EP | disclosed |
| EP-2484672-B1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND SALT THEREOF, AND HERBICIDE FOR AGRICULTURAL AND HORTICULTURAL USE | NIPPON SODA CO (JP) | 2015-07-15 | — | — | EP | disclosed |
| US-9060517-B2 | Nitrogenated heterocyclic compound and agricultural or horticultural fungicide | NIPPON SODA CO., LTD. (JP) | 2015-06-23 | — | — | US | disclosed |
| US-9062024-B2 | Nitrogen-containing heterocyclic compound and salt thereof, and a fungicide for agricultural and horticultural use | NIPPON SODA CO., LTD. (JP) | 2015-06-23 | — | — | US | disclosed |
| EP-2314583-B1 | NITROGENATED HETEROCYCLIC DERIVATIVE, AND AGRICULTURAL OR HORTICULTURAL BACTERICIDAL AGENT | NIPPON SODA CO (JP) | 2015-02-25 | — | — | EP | disclosed |
| US-8772200-B2 | Nitrogen-containing heterocyclic compound and agricultural fungicide | NIPPON SODA CO., LTD. (JP) | 2014-07-08 | — | — | US | disclosed |
| EP-2711361-A1 | NITROGENATED HETEROCYCLIC COMPOUND AND AGRICULTURAL OR HORTICULTURAL FUNGICIDE | Nippon Soda Co., Ltd. (JP) | 2014-03-26 | — | — | EP | disclosed |
| US-20140073792-A1 | NITROGENATED HETEROCYCLIC COMPOUND AND AGRICULTURAL OR HORTICULTURAL FUNGICIDE | NIPPON SODA CO., LTD. (JP) | 2014-03-13 | — | — | US | disclosed |
| US-8557738-B2 | Nitrogen-containing heterocyclic derivative and fungicide for agricultural and horticultural use | NIPPON SODA CO., LTD. (JP) | 2013-10-15 | — | — | US | disclosed |
| US-20120289702-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND AGRICULTURAL FUNGICIDE | NIPPON SODA CO., LTD. (JP) | 2012-11-15 | — | — | US | disclosed |
| EP-2522658-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND AGRICULTURAL/HORTICULTURAL GERMICIDE | Nippon Soda Co., Ltd. (JP) | 2012-11-14 | — | — | EP | disclosed |
| EP-2484672-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND SALT THEREOF, AND BACTERICIDE FOR AGRICULTURAL AND HORTICULTURAL USE | Nippon Soda Co., Ltd. (JP) | 2012-08-08 | — | — | EP | disclosed |
| US-20120184732-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND SALT THEREOF, AND A FUNGICIDE FOR AGRICULTURAL AND HORTICULTURAL USE | NIPPON SODA CO., LTD. | 2012-07-19 | — | — | US | disclosed |
| US-20110136782-A1 | NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE AND FUNGICIDE FOR AGRICULTURAL AND HORTICULTURAL USE | NIPPON SODA CO., LTD (JP) | 2011-06-09 | — | — | US | disclosed |
| EP-2314583-A1 | NITROGENATED HETEROCYCLIC DERIVATIVE, AND AGRICULTURAL OR HORTICULTURAL BACTERICIDAL AGENT | Nippon Soda Co., Ltd. (JP) | 2011-04-27 | — | — | EP | disclosed |
| EP-2280009-A1 | NITROGENOUS HETEROCYCLIC COMPOUNDS AND FUNGICIDES FOR AGRICULTURAL AND HORTICULTURAL USE | Nippon Soda Co., Ltd. (JP) | 2011-02-02 | — | — | EP | disclosed |