SCHEMBL3935902

SCHEMBL3935902

N#CCNCC(=O)O

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL5707704 0.97
SCHEMBL27734665 0.92 MCL1 (0.36)
Bicarbonate SCHEMBL18860473 0.84 MCL1 (0.37)
Acetic Acid SCHEMBL6315058 0.82 MCL1 (0.36)
Acetonitrile SCHEMBL9300100 0.81 CTH (0.37)
Acetonitrile SCHEMBL8744590 0.81 CTH (0.37)
SCHEMBL29952728 0.80
Acetic Acid SCHEMBL3939078 0.78 FFAR3 (0.41)
SCHEMBL11110429 0.77
Water SCHEMBL7340810 0.77

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1282596-A1 PREPARATION OF IMINODIACETIC ACID COMPOUNDS FROM MONOETHANOLAMINE SUBSTRATES Monsanto Technology LLC (US) 2003-02-12 EP claimed
WO-2001087827-A1 PREPARATION OF IMINODIACETIC ACID COMPOUNDS FROM MONOETHANOLAMINE SUBSTRATES MONSANTO TECHNOLOGY LLC (US) 2001-11-22 WO claimed
WO-2000076959-A2 INTERMEDIATES FOR THE PREPARATION OF (N)-[2-(CARBOXYMETHOXY) ETHYL]-(N)-(CARBOXYMETHYL) GLYCINE THE DOW CHEMICAL COMPANY (US) 2000-12-21 WO claimed
JP-56164150-A None JP disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-20210289794-A1 COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE FLAGSHIP PIONEERING INNOVATIONS V, INC. 2021-09-23 US disclosed
US-10464958-B2 Method for the synthesis of alpha-aminoalkylenephosphonic acid MONSANTO TECHNOLOGY LLC (US) 2019-11-05 US disclosed
US-20180346497-A1 METHOD FOR THE SYNTHESIS OF ALPHA-AMINOALKYLENEPHOSPHONIC ACID MONSANTO TECHNOLOGY LLC (US) 2018-12-06 US disclosed
US-20150232493-A1 METHOD FOR THE SYNTHESIS OF ALPHA-AMINOALKYLENEPHOSPHONIC ACID MONSANTO TECHNOLOGY LLC 2015-08-20 US disclosed
EP-2875035-A1 METHOD FOR THE SYNTHESIS OF ALPHA-AMINOALKYLENEPHOSPHONIC ACID Straitmark Holding AG (CH) 2015-05-27 EP disclosed
WO-2014012990-A1 METHOD FOR THE SYNTHESIS OF ALPHA-AMINOALKYLENEPHOSPHONIC ACID STRAITMARK HOLDING AG (CH) 2014-01-23 WO disclosed
US-20020019565-A1 Process for making iminodiacetic acid compounds from monoethanolamine substrates MONSANTO TECHNOLOGY LLC 2002-02-14 US disclosed
WO-2001087827-A1 PREPARATION OF IMINODIACETIC ACID COMPOUNDS FROM MONOETHANOLAMINE SUBSTRATES MONSANTO TECHNOLOGY LLC (US) 2001-11-22 WO disclosed
US-20010034457-A1 Method for producing long-chain glycine-N,N-diacetic acid derivatives BASF AKTIENGESELLSCHAFT (DE) 2001-10-25 US disclosed
US-6307086-B1 PREPARATION OF LONG-CHAIN SUBSTITUTED NITRILOTRIACETONITRILES FROM IMINODIACETONITRILE, LONG-CHAIN ALDEHYDE AND HCN OR ALKALI METAL CYANIDE OR FROM AN ALPHA-AMINO LONG-CHAIN NITRILE, FORMALDEHYDE AND HCN OR ALKALI METAL CYANIDE BASF AKTIENGESELLSCHAFT (DE) 2001-10-23 US disclosed
EP-1005447-A2 METHOD FOR PRODUCING LONG-CHAIN GLYCINE-N,N-DIACETIC ACID DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2000-06-07 EP disclosed
WO-1999010314-A2 METHOD FOR PRODUCING LONG-CHAIN GLYCINE-N,N-DIACETIC ACID DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 1999-03-04 WO disclosed
US-4459423-A Process for producing α-amino acids MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1984-07-10 US disclosed
EP-0067499-A1 Process for producing alpha-amino acids MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1982-12-22 EP disclosed
JP-S56164150-A PREPARATION OF ALKALI SALT OF IMINODIACETIC ACID MITSUBISHI CHEM IND LTD 1981-12-17 JP disclosed