SCHEMBL161658

SCHEMBL161658

N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACE P12821 5/20 0.58
NAALAD2 Q9Y3Q0 1/20 0.57
ALPI P09923 1/20 0.56
PKM P14618 1/20 0.56
PTGS1 P23219 1/20 0.56
XIAP P98170 1/20 0.56
SLC7A5 Q01650 1/20 0.56
LTA4H P09960 3/20 0.54
MME P08473 1/20 0.52
NPSR1 Q6W5P4 1/20 0.51
FAAH O00519 2/20 0.51

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
SCHEMBL9628000 1.00 ACE (0.58) ACENAALAD2ALPIPKMPTGS1
SCHEMBL161657 1.00 ACE (0.58) ACENAALAD2ALPIPKMPTGS1
SCHEMBL18222588 1.00 ACE (0.58) ACENAALAD2ALPIPKMPTGS1
Glutamic Acid SCHEMBL4387195 0.96 NAALAD2 (0.64) ACENAALAD2ALPIPKMPTGS1
D-Glutamate SCHEMBL4387193 0.96 NAALAD2 (0.64) ACENAALAD2ALPIPKMPTGS1
Methylmalonic Acid SCHEMBL29577852 0.93 ACE (0.52) ACENAALAD2ALPIPKMPTGS1
SCHEMBL15345879 0.91 LTA4H (0.62) ACELTA4HMME
SCHEMBL30803739 0.90 NAALAD2 (0.61) ACENAALAD2MME
SCHEMBL159886 0.89 NAALAD2 (0.59) ACENAALAD2SLC7A5MME
SCHEMBL159887 0.89 NAALAD2 (0.59) ACENAALAD2SLC7A5MME

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250270602-A1 STRAIN OF MICROORGANISMS AND PROCESS FOR THE FERMENTATIVE PRODUCTION OF GAMMA-GLUTAMYLTYROSINE AND GAMMA-GLUTAMYLPHENYLALANINE WACKER CHEMIE AG (DE) 2025-08-28 US claimed
CN-119780446-A Biomarker for milk cow early pregnancy related state and application thereof 宁夏大学 2025-04-08 CN claimed
WO-2025016303-A1 GLP-1, GIP AND GCG RECEPTOR TRIAGONIST AND USE THEREOF 北京拓界生物医药科技有限公司 2025-01-23 WO claimed
US-20240426830-A1 CHRONIC WOUND HEALING BIOMARKER DIAGNOSTICS THE TRUSTEES OF INDIANA UNIVERSITY 2024-12-26 US claimed
CN-116508912-B Fishing regulation composition with lipid-lowering and blood sugar-controlling functions, and preparation method and application thereof 华南农业大学 2024-12-10 CN claimed
EP-3969903-B1 METHOD OF SELECTING SKIN TREATMENT REGIMENS, INGREDIENTS AND COMPOSITIONS JOHNSON & JOHNSON CONSUMER INC (US) 2024-10-09 EP claimed
US-12050228-B2 Automated sample quality assessment METABOLON, INC. (US) 2024-07-30 US claimed
CN-117612741-A Novel coronavirus infection metabolic profile, and construction method, device, system and application thereof 首都医科大学附属北京朝阳医院 2024-02-27 CN claimed
WO-2023233945-A1 BILIARY TRACT CANCER TESTING METHOD 株式会社日立ハイテク 2023-12-07 WO claimed
CN-114373510-B Metabolic marker for diagnosing or monitoring lung cancer and screening method and application thereof 武汉迈特维尔医学科技有限公司 2023-12-01 CN claimed
WO-2014068144-A1 BIOMARKERS OF MULTIPLE MYELOMA DEVELOPMENT AND PROGRESSION OSPEDALE SAN RAFFAELE S.R.L. (IT) 2014-05-08 WO claimed
US-8658351-B2 Determining liver toxicity of an agent using metabolite biomarkers METABOLON, INC. (US) 2014-02-25 US claimed
WO-2013133715-A1 CULTURE MEDIUM FOR EUKARYOTIC CELLS FRIESLAND BRANDS B.V. (NL) 2013-09-12 WO claimed
WO-2013133714-A1 CULTURE MEDIUM FOR EUKARYOTIC CELLS FRIESLAND BRANDS B.V. (NL) 2013-09-12 WO claimed
US-20130224855-A1 CULTURE MEDIUM FOR EUKARYOTIC CELLS FRIESLANDCAMPINA NEDERLAND HOLDING B.V. (NL) 2013-08-29 US claimed
EP-2611904-A2 CULTURE MEDIUM FOR EUKARYOTIC CELLS Friesland Brands B.V. (NL) 2013-07-10 EP claimed
WO-2013070839-A1 BIOMARKERS FOR BLADDER CANCER AND METHODS USING THE SAME METABOLON, INC. (US) 2013-05-16 WO claimed
EP-2227689-B1 BIOMARKERS FOR FATTY LIVER DISEASE AND METHODS USING THE SAME METABOLON INC (US) 2012-12-26 EP claimed
WO-2012030217-A2 CULTURE MEDIUM FOR EUKARYOTIC CELLS FRIESLAND BRANDS B.V. (NL) 2012-03-08 WO claimed
EP-0266905-A1 Reagents for assay of gamma-glutamyl-transpeptidase UNITIKA LTD. (JP) 1988-05-11 EP claimed