⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3039 | 0.72 | — | — | |
| SCHEMBL644833 | 0.72 | — | — | |
| SCHEMBL5584076 | 0.72 | AHR (0.35) | — | |
| Hydrochloric Acid SCHEMBL9847456 | 0.70 | CYP3A4 (0.36) | — | |
| Hydrochloric Acid SCHEMBL4625306 | 0.70 | — | — | |
| SCHEMBL14935565 | 0.69 | — | — | |
| SCHEMBL102575 | 0.68 | — | — | |
| SCHEMBL97975 | 0.68 | — | — | |
| SCHEMBL1029479 | 0.68 | — | — | |
| SCHEMBL159601 | 0.68 | — | — |
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 406 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110114384-A | Curable compositions | 3M创新有限公司 | 2019-08-09 | — | — | CN | claimed |
| US-20180105538-A1 | BORONIC ACID DERIVATIVES | MERCK PATENT GMBH (DE) | 2018-04-19 | — | — | US | claimed |
| US-20170305864-A1 | HETEROCYCLIC COMPOUNDS AS PESTICIDES | BAYER CROPSCIENCE AG (DE) | 2017-10-26 | — | — | US | claimed |
| EP-2903440-B1 | HETEROCYCLIC COMPOUNDS AS PEST CONTROLLING AGENTS | BAYER CROPSCIENCE AG (DE) | 2017-09-06 | — | — | EP | claimed |
| CN-107074885-A | Boronic acid derivatives | 默克专利股份公司 | 2017-08-18 | — | — | CN | claimed |
| CN-103275019-B | The chloro-4-substituted anilinic of 4-[3-]-6-methoxyl group displacement formamido group quinazoline compounds and preparation and application | JIANG University OF TECHNOLOGY (CN) | 2016-05-18 | — | — | CN | claimed |
| CN-105101800-A | Heterocyclic compounds as pesticides | BAYER CROPSCIENCE AG | 2015-11-25 | — | — | CN | claimed |
| US-9133157-B2 | HIV protease inhibitors | MERCK CANADA INC. (CA) | 2015-09-15 | — | — | US | claimed |
| US-20150239847-A1 | HETEROCYCLIC COMPOUNDS AS PESTICIDES | BAYER CROPSCIENCE AG (DE) | 2015-08-27 | — | — | US | claimed |
| CN-104684955-A | Resin composition and composite structure containing resin | HEXCEL COMPOSITES LTD | 2015-06-03 | — | — | CN | claimed |
| EP-1086085-A1 | INHIBITORS OF p38 | Vertex Pharmaceuticals Incorporated (US) | 2001-03-28 | — | — | EP | claimed |
| EP-1077943-A1 | HETEROCYCLIC INHIBITORS OF P38 | Vertex Pharmaceuticals Incorporated (US) | 2001-02-28 | — | — | EP | claimed |
| WO-2000017175-A1 | INHIBITORS OF p38 | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2000-03-30 | — | — | WO | claimed |
| CN-1244867-A | Substituted nitrogen-containing heterocycles as P38 protein kinase inhibitors | VERTEX PHARMA (US) | 2000-02-16 | — | — | CN | claimed |
| WO-1999064400-A1 | INHIBITORS OF p38 | VERTEX PHARMACEUTICALS INCORPORATED (US) | 1999-12-16 | — | — | WO | claimed |
| WO-1999058502-A1 | HETEROCYCLIC INHIBITORS OF P38 | VERTEX PHARMACEUTICALS INCORPORATED (US) | 1999-11-18 | — | — | WO | claimed |
| EP-0951467-A1 | SUBSTITUTED NITROGEN CONTAINING HETEROCYCLES AS INHIBITORS OF p38 PROTEIN KINASE | Vertex Pharmaceuticals Incorporated (US) | 1999-10-27 | — | — | EP | claimed |
| WO-1998027098-A1 | SUBSTITUTED NITROGEN CONTAINING HETEROCYCLES AS INHIBITORS OF p38 PROTEIN KINASE | VERTEX PHARMACEUTICALS INCORPORATED (US) | 1998-06-25 | — | — | WO | claimed |
| EP-0031708-B1 | CEPHALOSPORIN DERIVATIVES, PROCESSES FOR THEIR MANUFACTURE, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND INTERMEDIATES THEREFOR | ICI PHARMA (FR) | 1984-06-13 | — | — | EP | claimed |
| EP-0031708-A2 | Cephalosporin derivatives, processes for their manufacture, pharmaceutical compositions containing them and intermediates therefor | ICI PHARMA (FR) | 1981-07-08 | — | — | EP | claimed |