SCHEMBL6236774

SCHEMBL6236774

NC(Cc1ccccc1)C(=O)NC(CCC(=O)O)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAALAD2 Q9Y3Q0 4/20 0.68
SLC15A1 P46059 1/20 0.59
POLB P06746 1/20 0.58
LTA4H P09960 1/20 0.56
CTSC P53634 1/20 0.55
ALPI P09923 1/20 0.54
PKM P14618 1/20 0.54
PTGS1 P23219 1/20 0.54
XIAP P98170 1/20 0.54
SLC7A5 Q01650 1/20 0.54
FOLH1 Q04609 3/20 0.53
GNPAT O15228 1/20 0.53
CPA3 P15088 1/20 0.53
MME P08473 1/20 0.51
GAA P10253 1/20 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
SCHEMBL3048911 1.00 NAALAD2 (0.68) NAALAD2SLC15A1POLBLTA4HCTSC
SCHEMBL3048908 1.00 NAALAD2 (0.68) NAALAD2SLC15A1POLBLTA4HCTSC
SCHEMBL6237394 0.97 NAALAD2 (0.64) NAALAD2SLC15A1POLBLTA4HCTSC
SCHEMBL27652943 0.97 NAALAD2 (0.64) NAALAD2SLC15A1POLBLTA4HCTSC
SCHEMBL30692726 0.96 NAALAD2 (0.67) NAALAD2SLC15A1POLBLTA4HCTSC
SCHEMBL30849218 0.95 NAALAD2 (0.61) NAALAD2SLC15A1POLBLTA4HCTSC
SCHEMBL30123529 0.94 NAALAD2 (0.60) NAALAD2SLC15A1POLBLTA4HCTSC
SCHEMBL22649263 0.94 NAALAD2 (0.60) NAALAD2SLC15A1POLBLTA4HCTSC
SCHEMBL29892222 0.93 NAALAD2 (0.67) NAALAD2SLC15A1POLBLTA4HGNPAT
SCHEMBL30688832 0.93 NAALAD2 (0.67) NAALAD2SLC15A1POLBLTA4HGNPAT

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-3805756-A1 SMALL MOLECULE BIOCHEMICAL PROFILING OF INDIVIDUAL SUBJECTS FOR DISEASE DIAGNOSIS AND HEALTH ASSESSMENT Metabolon, Inc. (US) 2021-04-14 EP claimed
CN-106537145-B Small molecule biochemical profiling of individual subjects for disease diagnosis and health assessment 麦特博隆股份有限公司 2020-08-25 CN claimed
CN-107236021-A A kind of synthetic method of polypeptide derivative 湖北泓肽生物科技有限公司 2017-10-10 CN claimed
CN-106537145-A Small molecule biochemical profiling of individual subjects for disease diagnosis and health assessment 麦特博隆股份有限公司 2017-03-22 CN claimed
EP-3129909-A1 SMALL MOLECULE BIOCHEMICAL PROFILING OF INDIVIDUAL SUBJECTS FOR DISEASE DIAGNOSIS AND HEALTH ASSESSMENT Metabolon, Inc. (US) 2017-02-15 EP claimed
WO-2015157407-A1 SMALL MOLECULE BIOCHEMICAL PROFILING OF INDIVIDUAL SUBJECTS FOR DISEASE DIAGNOSIS AND HEALTH ASSESSMENT METABOLON, INC. (US) 2015-10-15 WO claimed
WO-2005016959-A1 BIOLOGICALLY ACTIVE PEPTIDES COMPRISING PHENYLALANYL-GLUTAMATE (FE) AND PHENYLALANYL-GLUTAMYL-GLUTAMATE (FEE) PEPHARM R & D LIMITED (CN) 2005-02-24 WO claimed
CN-117269494-A A group of metabolic markers for breast cancer lung metastasis 厦门大学 2023-12-22 CN disclosed
EP-3805756-A1 SMALL MOLECULE BIOCHEMICAL PROFILING OF INDIVIDUAL SUBJECTS FOR DISEASE DIAGNOSIS AND HEALTH ASSESSMENT Metabolon, Inc. (US) 2021-04-14 EP disclosed
CN-107236021-B Synthetic method of polypeptide derivative 湖北泓肽生物科技有限公司 2020-12-01 CN disclosed
EP-3129909-B1 SMALL MOLECULE BIOCHEMICAL PROFILING OF INDIVIDUAL SUBJECTS FOR DISEASE DIAGNOSIS AND HEALTH ASSESSMENT METABOLON INC (US) 2020-09-16 EP disclosed
CN-106537145-B Small molecule biochemical profiling of individual subjects for disease diagnosis and health assessment 麦特博隆股份有限公司 2020-08-25 CN disclosed
US-10267777-B2 Small molecule biochemical profiling of individual subjects for disease diagnosis and health assessment METABOLON, INC. (US) 2019-04-23 US disclosed
CN-1930183-B Bioactive peptides comprising phenylalanyl-glutamic acid and phenylalanyl-glutamyl-glutamic acid PEPHARM R & D LTD 2010-12-29 CN disclosed
CN-1930183-B Bioactive peptides comprising phenylalanyl-glutamic acid and phenylalanyl-glutamyl-glutamic acid PEPHARM R & D LTD 2010-12-29 CN disclosed
CN-1930183-A Bioactive peptides comprising phenylalanyl-glutamic acid and phenylalanyl-glutamyl-glutamic acid PEPHARM R & D LTD (CN) 2007-03-14 CN disclosed
CN-1930183-A Bioactive peptides comprising phenylalanyl-glutamic acid and phenylalanyl-glutamyl-glutamic acid PEPHARM R & D LTD (CN) 2007-03-14 CN disclosed
WO-2005016959-A1 BIOLOGICALLY ACTIVE PEPTIDES COMPRISING PHENYLALANYL-GLUTAMATE (FE) AND PHENYLALANYL-GLUTAMYL-GLUTAMATE (FEE) PEPHARM R & D LIMITED (CN) 2005-02-24 WO disclosed
WO-2005016959-A1 BIOLOGICALLY ACTIVE PEPTIDES COMPRISING PHENYLALANYL-GLUTAMATE (FE) AND PHENYLALANYL-GLUTAMYL-GLUTAMATE (FEE) PEPHARM R & D LIMITED (CN) 2005-02-24 WO disclosed
WO-1989001005-A1 ONE-STEP POLYMERIZATION OF POLYANHYDRIDES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1989-02-09 WO disclosed