⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL514741 | 0.97 | — | — | |
| SCHEMBL28046269 | 0.94 | — | — | |
| SCHEMBL12669935 | 0.88 | — | — | |
| SCHEMBL29164954 | 0.77 | — | — | |
| SCHEMBL7456498 | 0.72 | — | — | |
| SCHEMBL5592147 | 0.70 | HTT (0.35) | — | |
| SCHEMBL1996884 | 0.67 | NPSR1 (0.35) | — | |
| SCHEMBL25583806 | 0.67 | — | — | |
| SCHEMBL27753191 | 0.67 | — | — | |
| SCHEMBL4693128 | 0.67 | MME (0.31) | — |
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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4021878-B1 | METHOD FOR PRODUCING METHACROLEIN FROM FORMALDEHYDE AND PROPIONALDEHYDE AND PRODUCTION PLANT THEREFOR | ROEHM GMBH (DE) | 2023-08-09 | — | — | EP | disclosed |
| EP-3786146-A1 | METHOD FOR PRODUCING METHACROLEIN FROM FORMALDEHYDE AND PROPIONALDEHYDE AND PRODUCTION PLANT THEREFOR | Röhm GmbH (DE) | 2021-03-03 | — | — | EP | disclosed |
| EP-3786147-A1 | METHOD FOR PRODUCING METHACROLEIN FROM FORMALDEHYDE AND PROPIONALDEHYDE AND PRODUCTION PLANT THEREFOR | Röhm GmbH (DE) | 2021-03-03 | — | — | EP | disclosed |
| EP-3769776-A1 | PEPTIDOMIMETIC MACROCYCLES | Aileron Therapeutics, Inc. (US) | 2021-01-27 | — | — | EP | disclosed |
| EP-3024811-B1 | CIRCULATION AND DISPOSAL OF THE AQUEOUS CATALYST SOLUTION IN AMINE CATALYTIC PROCESSES | ROEHM GMBH (DE) | 2019-11-20 | — | — | EP | disclosed |
| EP-2986589-B1 | METHOD FOR PRODUCING METHYL METHACRYLATE | EVONIK ROEHM GMBH (DE) | 2018-03-14 | — | — | EP | disclosed |
| WO-2017165299-A2 | COMPANION DIAGNOSTIC TOOL FOR PEPTIDOMIMETIC MACROCYCLES | AILERON THERAPEUTICS, INC. (US) | 2017-09-28 | — | — | WO | disclosed |
| WO-2017004548-A1 | PEPTIDOMIMETIC MACROCYCLES | AILERON THERAPEUTICS, INC. (US) | 2017-01-05 | — | — | WO | disclosed |
| EP-3080067-A1 | TERTIARY ALKYLAMINES AS METHACROLEIN SYNTHESIS CO-CATALYST | Evonik Röhm GmbH (DE) | 2016-10-19 | — | — | EP | disclosed |
| WO-2016154058-A1 | PEPTIDOMIMETIC MACROCYCLES AND USES THEREOF | AILERON THERAPEUTICS, INC. (US) | 2016-09-29 | — | — | WO | disclosed |
| WO-2014170223-A1 | METHOD FOR PRODUCING METHYLMETHACRYLATE | EVONIK INDUSTRIES AG (DE) | 2014-10-23 | — | — | WO | disclosed |
| WO-2014138429-A2 | PEPTIDOMIMETIC MACROCYCLES AND USE THEREOF IN REGULATING HIF1ALPHA | AILERON THERAPEUTICS, INC. (US) | 2014-09-12 | — | — | WO | disclosed |
| WO-2013123266-A1 | PEPTIDOMIMETIC MACROCYCLES | AILERON THERAPEUTICS, INC. (US) | 2013-08-22 | — | — | WO | disclosed |
| WO-2013059525-A1 | PEPTIDOMIMETIC MACROCYLES | AILERON THERAPEUTICS, INC. (US) | 2013-04-25 | — | — | WO | disclosed |
| US-7998951-B2 | treating hepatitis C infection; 6-cyclohexyl-2,3-dihydro-5-phenyl-1,4-oxazino[2,3,4-hi]indole-9-carboxylic acid | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-08-16 | — | — | US | disclosed |
| EP-2048235-A2 | Synthetic Mammalian Alpha-N-Acetylglucosaminidase and Genetic Sequences Encoding Same | WOMEN'S AND CHILDREN'S HOSPITAL (AU) | 2009-04-15 | — | — | EP | disclosed |
| WO-2007117180-A1 | AZAHETEROCYCLES, COMBINATORY LIBRARY, FOCUSED LIBRARY, PHARMACEUTICAL COMPOSITION AND METHODS FOR THE PRODUCTION THEREOF | 'CHEMICAL DIVERSITY RESEARCH INSTITUTE' LTD. (RU) | 2007-10-18 | — | — | WO | disclosed |
| US-6414128-B1 | LEPTIN LIGAND BINDING; MEDICAL DIAGNOSIS, THERAPY, AGONISTS, AND ANTAGONISTS; GENETIC ENGINEERING | AMRAD OPERATIONS PTY. LTD. (AU) | 2002-07-02 | — | — | US | disclosed |
| EP-0092097-B1 | PROCESS FOR THE PREPARATION OF ALPHA-ALKYL ACROLEINS | BASF Aktiengesellschaft (DE) | 1985-01-16 | — | — | EP | disclosed |
| EP-0092097-A1 | Process for the preparation of alpha-alkyl acroleins | BASF Aktiengesellschaft (DE) | 1983-10-26 | — | — | EP | disclosed |