SCHEMBL232926

SCHEMBL232926

CC(C)=CC(=O)NCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
HPGD P15428 1/20 0.47
CTH P32929 1/20 0.43
EGLN1 Q9GZT9 2/20 0.41
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
PTGS2 P35354 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ITGB3 P05106 1/20 0.39
ITGB1 P05556 1/20 0.39
ITGAV P06756 1/20 0.39
ITGA5 P08648 1/20 0.39
POLB P06746 1/20 0.37
APEX1 P27695 1/20 0.36
ECE1 P42892 1/20 0.35
CYP2D6 P10635 1/20 0.35
FAAH O00519 1/20 0.35
CYP2C9 P11712 1/20 0.35
NPC1 O15118 2/20 0.34

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
SCHEMBL23140063 0.83 SMN1; SMN2 (0.44) ALDH1A1SMN1; SMN2HPGDLMNATDP1
SCHEMBL7383145 0.82 CTH (0.40) ALDH1A1SMN1; SMN2HPGDCTHEGLN1
SCHEMBL7383149 0.82 CTH (0.40) ALDH1A1SMN1; SMN2HPGDCTHEGLN1
SCHEMBL11983352 0.79 CTH (0.38) ALDH1A1SMN1; SMN2HPGDCTHEGLN1
Aceglumate SCHEMBL29061503 0.78 FOLH1 (0.51) ALDH1A1SMN1; SMN2MAPTPTGS2NFKB1
SCHEMBL15482649 0.77 TET2 (0.48) ALDH1A1SMN1; SMN2HPGDTSHRGAA
SCHEMBL29054450 0.77 KDM4E (0.59) MAPTPOLB
SCHEMBL17373960 0.76 EGLN1 (0.48) ALDH1A1CTHEGLN1LMNAMAPT
SCHEMBL24599175 0.76 SMN1; SMN2 (0.40) ALDH1A1SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL23134791 0.76 SMN1; SMN2 (0.40) ALDH1A1SMN1; SMN2HPGDCYP2C9NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118005991-B Solid anticoagulation microsphere and preparation method and application thereof 乾德生物医疗技术(广州)有限公司 2024-10-15 CN claimed
US-12050228-B2 Automated sample quality assessment METABOLON, INC. (US) 2024-07-30 US claimed
CN-118005991-A Solid anticoagulation microsphere and preparation method and application thereof 乾德生物医疗技术(广州)有限公司 2024-05-10 CN claimed
US-11906510-B2 Metabolic profiling by reverse-phase/ion-exchange mass spectrometry STANFORD JUNIOR UNIVERSITY (US) 2024-02-20 US claimed
CN-116660543-A Diagnostic and prognostic markers for nonalcoholic fatty liver disease and uses thereof 中国人民解放军陆军军医大学第一附属医院 2023-08-29 CN claimed
CN-113777189-A 3-methylcrotonyl coenzyme A carboxylase deficiency detection device and organic acid detection method 深圳爱湾医学检验实验室 2021-12-10 CN claimed
EP-3805756-A1 SMALL MOLECULE BIOCHEMICAL PROFILING OF INDIVIDUAL SUBJECTS FOR DISEASE DIAGNOSIS AND HEALTH ASSESSMENT Metabolon, Inc. (US) 2021-04-14 EP claimed
US-20210088539-A1 AUTOMATED SAMPLE QUALITY ASSESSMENT METABOLON, INC. 2021-03-25 US claimed
US-10890592-B2 Automated sample quality assessment METABOLON, INC. (US) 2021-01-12 US 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
US-8608922-B2 Biosensor for continuous monitoring of metabolites and proteins and methods of manufacture thereof THE UNIVERSITY OF CONNECTICUT (US) 2013-12-17 US claimed
US-20130276513-A1 METHODS FOR DIAGNOSING AND ASSESSING KIDNEY DISEASE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2013-10-24 US claimed
WO-2013070839-A1 BIOMARKERS FOR BLADDER CANCER AND METHODS USING THE SAME METABOLON, INC. (US) 2013-05-16 WO claimed
WO-2012019295-A1 BIOACTIVE COMPOUNDS IN CAMEL URINE AND MILK ANTAKLY TONY (CA) 2012-02-16 WO claimed
WO-2011051813-A1 COMPOSITIONS AND METHODS FOR TREATING DERMATOLOGICAL CONDITIONS PAUL HARBHAJAN S (US) 2011-05-05 WO claimed
US-20110098229-A1 COMPOSITIONS AND METHODS FOR TREATING DERMATOLOGICAL CONDITIONS BIOMED RESEARCH & TECHNOLOGIES, INC. 2011-04-28 US claimed
US-20100116691-A1 BIOSENSOR FOR CONTINUOUS MONITORING OF METABOLITES AND PROTEINS AND METHODS OF MANUFACTURE THEREOF UNIVERSITY OF CONNECTICUT (US) 2010-05-13 US claimed
EP-1098630-A2 COMPOSITION FOR ENHANCING EPIDERMAL LIPID PRODUCTION Biomed Research and Technologies, Inc. (US) 2001-05-16 EP claimed
US-6149924-A FOR TOPICAL APPLICATION BIOMED RESEARCH & TECHNOLOGIES, INC. (US) 2000-11-21 US claimed
WO-2000004870-A2 COMPOSITION FOR ENHANCING EPIDERMAL LIPID PRODUCTION BIOMED RESEARCH AND TECHNOLOGIES, INC. (US) 2000-02-03 WO claimed