SCHEMBL2916871

SCHEMBL2916871

O=C(O)C[C@H](NCCN(CCO)[C@@H](CC(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL2132901 0.86 GGT1 (0.36) CA2CA4
SCHEMBL2450587 0.83 TDP1 (0.39)
SCHEMBL2684367 0.82 GGT1 (0.37)
SCHEMBL2682852 0.81 GGT1 (0.36)
SCHEMBL2133303 0.79 GGT1 (0.33)
SCHEMBL2130425 0.79 GGT1 (0.33)
SCHEMBL2684099 0.79 GGT1 (0.36)
SCHEMBL2913318 0.76 KDM4E (0.34) CA2CA4
SCHEMBL2446847 0.75 CA2 (0.41) CA2CA4
SCHEMBL2901325 0.75 CA2 (0.41) CA2CA4

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783034-B1 Chelating agent and detergent comprising the same MITSUBISHI RAYON CO (JP) 2010-08-18 EP disclosed
US-6451757-B2 ASPARTIC ACID, MALEIC ACID, ACRYLIC ACID, MALIC ACID, GLYCINE, GLYCOLIC ACID, IMINODIACETIC ACID, NITRILOTRIACETIC ACID, ALPHA-ALANINE, BETA-ALANINE, IMINODIPROPIONIC ACID, FUMARIC ACID, A SYNTHETIC AMINO ACID; BIODEGRADABLE MITSUBISHI RAYON CO., LTD. (JP) 2002-09-17 US disclosed
US-6426229-B1 ASPARTIC, MALEIC, ACRYLIC, MALIC, GLYCINE, GLYCOLIC,IMINODIACETIC, NITRILOTRIACETIC,BETA-ALANINE, IMINODIPROPIONIC, AND FUMARIC ACIDS, SYNTHETIC STARTING AND INTERMEDIATE AMINO ACIDS; BIODEGRADAABLE MITSUBISHI RAYON CO., LTD. (JP) 2002-07-30 US disclosed
US-20020039980-A1 Chelating agent and detergent comprising the same MITSUBISHI RAYON CO., LTD. 2002-04-04 US disclosed
US-20010034318-A1 Chelating agent and detergent comprising the same NITTO CHEMICAL INDUSTRY CO., LTD (NAME CHANGED TO MITSUBISHI RAYON CO., LTD.) 2001-10-25 US disclosed
US-6221834-B1 (S)-ASPARTIC ACID-N,N-DIACETIC ACID (ASDA) OR ALKALI METAL SALTS OR AMMONIA SALTS THEREOF AND (II) ASPARTIC ACID, MALIC ACID, IMINODIACETIC ACID (IDA), NITRILOTRIACETIC ACID (NTA) OR FUMARIC ACID MITSUBISHI RAYON CO., LTD. (JP) 2001-04-24 US disclosed
EP-0783034-A2 Chelating agent and detergent comprising the same NITTO CHEMICAL INDUSTRY CO., LTD. (JP) 1997-07-09 EP disclosed