SCHEMBL1038668

SCHEMBL1038668

N[C@H](CCSCC(=O)O)C(=O)O

nearest known ligand 0.92

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BHMT Q93088 11/20 0.92
BHMT2 Q9H2M3 1/20 0.58
NOS2 P35228 2/20 0.53
NOS3 P29474 1/20 0.53
NOS1 P29475 1/20 0.53
GRM8 O00222 1/20 0.52
GRM6 O15303 1/20 0.52
GRIN2D O15399 1/20 0.52
GRIN3B O60391 1/20 0.52
GSR P00390 1/20 0.52
CYP1A2 P05177 1/20 0.52
GRIK1 P39086 1/20 0.52
GRM5 P41594 1/20 0.52
GRIA1 P42261 1/20 0.52
GRIA2 P42262 1/20 0.52
GRIA3 P42263 1/20 0.52
SLC1A3 P43003 1/20 0.52
SLC1A2 P43004 1/20 0.52
SLC1A1 P43005 1/20 0.52
GRIA4 P48058 1/20 0.52

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
SCHEMBL1038667 1.00 BHMT (0.92) BHMTBHMT2NOS2NOS3NOS1
SCHEMBL9056803 1.00 BHMT (0.92) BHMTBHMT2NOS2NOS3NOS1
Lysine SCHEMBL9746897 0.88 BHMT (0.72) BHMTBHMT2NOS2NOS3NOS1
SCHEMBL6664390 0.87 BHMT (0.71) BHMTBHMT2NOS2NOS3NOS1
SCHEMBL1031686 0.86 BHMT (0.76) BHMTBHMT2NOS2NOS3NOS1
SCHEMBL21851894 0.86 BHMT (0.76) BHMTBHMT2NOS2NOS3NOS1
SCHEMBL1031684 0.86 BHMT (0.76) BHMTBHMT2NOS2NOS3NOS1
SCHEMBL14125538 0.85 BHMT (0.69) BHMTBHMT2NOS2NOS3NOS1
SCHEMBL14125660 0.85 BHMT (0.69) BHMTBHMT2NOS2NOS3NOS1
SCHEMBL14125658 0.85 BHMT (0.69) BHMTBHMT2NOS2NOS3NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4288433-A THIOETHER AND A XANTHINE DERIVATIVE L'OREAL (FR) 1981-09-08 US claimed
EP-1879613-B1 PEPTIDE CONJUGATE COMPOSITIONS AND METHODS FOR THE PREVENTION AND TREATMENT OF ALZHEIMER'S DISEASE MERCK SHARP & DOHME (US) 2011-11-30 EP disclosed
CN-101171031-B Peptide conjugate compositions and methods for the prevention and treatment of alzheimer's disease MERCK & CO INC 2011-09-28 CN disclosed
US-20110052611-A1 PEPTIDE CONJUGATE COMPOSITIONS AND METHODS FOR THE PREVENTION AND TREATMENT OF ALZHEIMER'S DISEASE GARSKY VICTOR M 2011-03-03 US disclosed
EP-2269633-A1 Peptide conjugate compositions and methods for the prevention and treatment of Alzheimer's disease Merck Sharp & Dohme Corp. (US) 2011-01-05 EP disclosed
US-7850973-B2 Peptide conjugate compositions and methods for the prevention and treatment of alzheimer's disease MERCK SHARP & DOHME CORP. (US) 2010-12-14 US disclosed
EP-0497525-B2 Pneumococcal polysaccharide conjugate vaccine MERCK & CO INC (US) 2010-03-03 EP disclosed
US-20090098155-A1 Peptide conjugate compositions and methods for the prevention and treatment of alzheimer's disease MERCK SHARP & DOHME CORP. 2009-04-16 US disclosed
US-20090047303-A1 Method for improving the immunogenicity of plasmodium antigens MERCK SHARP & DOHME CORP. 2009-02-19 US disclosed
EP-1603590-A4 INFLUENZA VIRUS VACCINE MERCK & CO INC (US) 2008-08-27 EP disclosed
EP-0161188-B1 COVALENTLY-MODIFIED BACTERIAL POLYSACCHARIDES, STABLE COVALENT CONJUGATES OF SUCH POLYSACCHARIDES AND IMMUNOGENIC PROTEINS WITH BIGENERIC SPACERS, AND METHODS OF PREPARING SUCH POLYSACCHARIDES AND CONJUGATES AND OF CONFIRMING COVALENCY MERCK & CO. INC. (US) 1991-04-03 EP disclosed
EP-0402088-A2 Conjugate immunogen for aids MERCK & CO. INC. (US) 1990-12-12 EP disclosed
US-4882317-A SOLUBILIZATION MERCK & CO., INC. (US) 1989-11-21 US disclosed
US-4830852-A COVALENT-MODIFICATION AND HAVING A COUPLING SPACER CONTAINING A THIOETHER; VACCINES; CHEMICAL STABILITY; INFANT PROTECTION MERCK & CO INC. (US) 1989-05-16 US disclosed
US-4695624-A Covalently-modified polyanionic bacterial polysaccharides, stable covalent conjugates of such polysaccharides and immunogenic proteins with bigeneric spacers, and methods of preparing such polysaccharides and conjugates and of confirming covalency MERCK & CO., INC. (US) 1987-09-22 US disclosed
CN-85104164-A Preparation method of covalent conjugate of bacterial polysaccharide and immunogen protein 1987-02-04 CN disclosed
CN-85108890-A The preparation covalent modification neutral bacterial polysaccharides and with the method that causes the banded stable covalent conjunct agent of immune protein 1986-11-19 CN disclosed
EP-0186576-A2 Covalently-modified neutral bacterial polysaccharides, stable covalent conjugates of such polysaccharides and immunogenic proteins, and methods of preparing such polysaccharides and conjugates MERCK & CO. INC. (US) 1986-07-02 EP disclosed
EP-0161188-A2 Covalently-modified bacterial polysaccharides, stable covalent conjugates of such polysaccharides and immunogenic proteins with bigeneric spacers, and methods of preparing such polysaccharides and conjugates and of confirming covalency MERCK & CO. INC. (US) 1985-11-13 EP disclosed
US-4288433-A THIOETHER AND A XANTHINE DERIVATIVE L'OREAL (FR) 1981-09-08 US disclosed