⚠ 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 | |
|---|---|---|---|---|
| Acetonitrile SCHEMBL64583 | 0.95 | UPP1 (0.33) | — | |
| SCHEMBL505679 | 0.81 | ALDH1A1 (0.38) | — | |
| Acetonitrile SCHEMBL64993 | 0.79 | MEN1 (0.30) | — | |
| Diethanolamine SCHEMBL64497 | 0.79 | TP53 (0.35) | — | |
| Diethanolamine SCHEMBL3650913 | 0.79 | TP53 (0.35) | — | |
| SCHEMBL12921486 | 0.78 | CA12 (0.36) | — | |
| Water SCHEMBL7340810 | 0.75 | — | — | |
| SCHEMBL11110429 | 0.75 | — | — | |
| SCHEMBL3429842 | 0.74 | — | — | |
| SCHEMBL428246 | 0.73 | — | — |
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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1282596-B1 | PREPARATION OF IMINODIACETIC ACID COMPOUNDS FROM MONOETHANOLAMINE SUBSTRATES | MONSANTO TECHNOLOGY LLC (US) | 2006-08-30 | — | — | EP | claimed |
| US-20030176735-A1 | Process for making iminodiacetic acid compounds from monoethanolamine substrates | MONSANTO TECHNOLOGY LLC | 2003-09-18 | — | — | US | claimed |
| CN-1436167-A | Preparation of iminodiacetic acid compounds from monoethanolamine | MONSANTO TECHNOLOGY LLC (US) | 2003-08-13 | — | — | CN | claimed |
| US-6555706-B2 | Cyanoethylation, hydrolysis, dehydrogenation of ethanolamine | MONSANTO COMPANY | 2003-04-29 | — | — | US | claimed |
| EP-1282596-A1 | PREPARATION OF IMINODIACETIC ACID COMPOUNDS FROM MONOETHANOLAMINE SUBSTRATES | Monsanto Technology LLC (US) | 2003-02-12 | — | — | EP | claimed |
| US-20020019565-A1 | Process for making iminodiacetic acid compounds from monoethanolamine substrates | MONSANTO TECHNOLOGY LLC | 2002-02-14 | — | — | US | claimed |
| WO-2001087827-A1 | PREPARATION OF IMINODIACETIC ACID COMPOUNDS FROM MONOETHANOLAMINE SUBSTRATES | MONSANTO TECHNOLOGY LLC (US) | 2001-11-22 | — | — | WO | claimed |
| WO-2023138592-A1 | SALT FORM CRYSTAL FORM OF PYRIMIDINE DERIVATIVE AND PREPARATION METHOD THEREFOR | 科岭源生物科技(深圳)有限公司 | 2023-07-27 | — | — | WO | disclosed |
| US-9994547-B2 | Heteroarylamide inhibitors of TBK1 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-06-12 | — | — | US | disclosed |
| US-20170313675-A1 | HETEROARYLAMIDE INHIBITORS OF TBK1 | TAKEDA CALIFORNIA, INC. | 2017-11-02 | — | — | US | disclosed |
| WO-2016057338-A1 | HETEROARYLAMIDE INHIBITORS OF TBK1 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-04-14 | — | — | WO | disclosed |
| US-7964736-B2 | Phosphagen synthesis | NOUR HEART, INC. (US) | 2011-06-21 | — | — | US | disclosed |
| US-7964736-B2 | Phosphagen synthesis | NOUR HEART, INC. (US) | 2011-06-21 | — | — | US | disclosed |
| EP-0844261-A1 | Dispersions containing polyurethanes with carbonyl groups in ketone function | BASF AKTIENGESELLSCHAFT (DE) | 1998-05-27 | — | — | EP | disclosed |
| US-5726341-A | HYDROLYSIS, DESALTING | THE DOW CHEMICAL COMPANY (US) | 1998-03-10 | — | — | US | disclosed |
| WO-1997021669-A1 | AN AMINO NITRILE INTERMEDIATE FOR THE PREPARATION OF 2-HYDROXYETHYL IMINODIACETIC ACID | THE DOW CHEMICAL COMPANY (US) | 1997-06-19 | — | — | WO | disclosed |
| WO-1997011103-A1 | DISPERSIONS CONTAINING POLYURETHANES WITH CARBONYL GROUPS IN THE KETO FUNCTION | BASF AKTIENGESELLSCHAFT (DE) | 1997-03-27 | — | — | WO | disclosed |
| CN-1084173-A | 1-azabicyclo [3,2,0] hept-2-ene\"-2-carboxylic acid derivative and preparation thereof | FUJISAWA PHARMACEUTICAL CO (JP) | 1994-03-23 | — | — | CN | disclosed |
| EP-0236263-B1 | SUBSTITUTED PYRROLIDINONES | CIBA-GEIGY AG (CH) | 1992-12-30 | — | — | EP | disclosed |
| US-4945092-A | Substituted 1-(oxopyrrolidinylalkanoyl)-piperazines useful as nootropics | CIBA-GEIGY CORPORATION (US) | 1990-07-31 | — | — | US | disclosed |