⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10769108 | 0.80 | — | — | |
| SCHEMBL9046121 | 0.79 | — | — | |
| SCHEMBL10343927 | 0.79 | ALDH1A1 (0.35) | — | |
| SCHEMBL1453644 | 0.74 | — | — | |
| SCHEMBL10725876 | 0.74 | — | — | |
| SCHEMBL415666 | 0.74 | DNM1 (0.41) | — | |
| SCHEMBL27495859 | 0.72 | — | — | |
| SCHEMBL10698443 | 0.72 | DNM1 (0.44) | — | |
| SCHEMBL10907879 | 0.72 | — | — | |
| SCHEMBL23890643 | 0.71 | — | — |
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 482 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2881395-B1 | PIPERAZINOTRIAZOLE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF IN DRUG PREPARATION | SHANGHAI INST MATERIA MEDICA CAS (CN) | 2018-09-05 | — | — | EP | claimed |
| US-9255106-B2 | Substituted [1,2,4]triazolo[4,3-a]pyrazines as PARP-1 inhibitors | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2016-02-09 | — | — | US | claimed |
| US-20150166544-A1 | PIPERAZINOTRIAZOLE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF IN DRUG PREPARATION | SHANGHAI ACEBRIGHT PHARMACEUTICALS CO., LTD. (CN) | 2015-06-18 | — | — | US | claimed |
| EP-2881395-A1 | PIPERAZINOTRIZOLE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF IN DRUG PREPARATION | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2015-06-10 | — | — | EP | claimed |
| CN-103269593-A | Alkylsulfinyl-ubstituted thiazolide compounds | ROMARK LAB LC | 2013-08-28 | — | — | CN | claimed |
| CN-102532235-A | Bufogenin derivative and preparation method thereof, composition containing bufogenin derivative and applications thereof | SHANGHAI INST MATERIA MEDICA | 2012-07-04 | — | — | CN | claimed |
| CN-101970394-A | Novel cyclic hydrocarbon compounds for the treatment of diseases | LEO PHARMA AS | 2011-02-09 | — | — | CN | claimed |
| CN-101384592-A | Antiviral compounds | ABBOTT LAB (US) | 2009-03-11 | — | — | CN | claimed |
| CN-101289414-A | Monoazo compounds, preparation method and uses thereof | WEIGANG RUAN (CN) | 2008-10-22 | — | — | CN | claimed |
| CN-100381428-C | Quinazolinone compound and application thereof | CYTOKINETICS INC (US) | 2008-04-16 | — | — | CN | claimed |
| CN-1118464-C | Noval pyrimidine derivatives and process and preparing thereof | YUHAN CORP (KR) | 2003-08-20 | — | — | CN | claimed |
| US-6346633-B1 | TERT-AMINOPHENYLESTER OF ACID | ASTRAZENECA AB (SE) | 2002-02-12 | — | — | US | claimed |
| EP-1064253-A1 | ANTI-TUMOUR AGENTS | AstraZeneca AB (SE) | 2001-01-03 | — | — | EP | claimed |
| CN-1264377-A | Substituted pyrazoles as P38 kinase inhabitors | SEARLE & CO (US) | 2000-08-23 | — | — | CN | claimed |
| WO-1999048857-A1 | ANTI-TUMOUR AGENTS | ASTRAZENECA AB (SE) | 1999-09-30 | — | — | WO | claimed |
| EP-0423482-A1 | 5H-furan-2-one derivatives | BAYER AG (DE) | 1991-04-24 | — | — | EP | claimed |
| EP-0288789-A1 | N-arylpyrroline-2,5-diones | BAYER AG (DE) | 1988-11-02 | — | — | EP | claimed |
| EP-0099303-B1 | BENZOTHIOPYRANOPYRIDINONES AND THEIR SALTS, THEIR PREPARATION AND USE AS MEDICAMENTS, AND COMPOSITIONS CONTAINING THEM | ROUSSEL-UCLAF (FR) | 1987-08-19 | — | — | EP | claimed |
| EP-0099303-A2 | Benzothiopyranopyridinones and their salts, their preparation and use as medicaments, and compositions containing them | ROUSSEL-UCLAF (FR) | 1984-01-25 | — | — | EP | claimed |
| US-4296039-A | REACTING 2-HALORESORCINOLS OR THEIR MONOETHERS WITH BETA-KETO ESTERS | FIDIA S.P.A. (IT) | 1981-10-20 | — | — | US | claimed |