SCHEMBL6137585

SCHEMBL6137585

CC(C(=O)NCC(=O)O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.62
ACE P12821 3/20 0.58
ERCC1 P07992 1/20 0.55
ERCC4 Q92889 1/20 0.55
ALDH1A1 P00352 3/20 0.50
MAPT P10636 2/20 0.50
LMNA P02545 1/20 0.50
PTGS2 P35354 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
GRM7 Q14831 2/20 0.49
HPGD P15428 1/20 0.49
MAPK1 P28482 1/20 0.49
HSD17B10 Q99714 1/20 0.49
POLB P06746 1/20 0.49
MEN1 O00255 1/20 0.49
ECE1 P42892 1/20 0.49
BLM P54132 1/20 0.49
NPEPPS P55786 1/20 0.49
KMT2A Q03164 1/20 0.49
ITGB3 P05106 1/20 0.47

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
SCHEMBL3147315 0.85 MME (0.51) MMEACEERCC1ERCC4ALDH1A1
SCHEMBL4385872 0.85 MME (0.51) MMEACEERCC1ERCC4ALDH1A1
SCHEMBL18255328 0.84 ALDH1A1 (0.57) MMEACEERCC1ERCC4ALDH1A1
SCHEMBL3143059 0.83 GLI1 (0.65) ALDH1A1MAPTLMNAPTGS2HPGD
SCHEMBL19523017 0.83 PKM (0.58) ERCC1ERCC4ALDH1A1LMNAGRM7
SCHEMBL10138151 0.83 PKM (0.58) ERCC1ERCC4ALDH1A1LMNAGRM7
SCHEMBL27598564 0.82 PTGS1 (0.65) MMEACEERCC1ERCC4LMNA
SCHEMBL1891876 0.82 PTGS1 (0.65) MMEACEERCC1ERCC4LMNA
SCHEMBL14540295 0.82 ERCC1 (0.52) MMEACEERCC1ERCC4ALDH1A1
SCHEMBL3200580 0.82 ERCC1 (0.52) MMEACEERCC1ERCC4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12050228-B2 Automated sample quality assessment METABOLON, INC. (US) 2024-07-30 US claimed
US-20230233620-A1 HIGH-COMPLEXITY SYNTHETIC GUT BACTERIAL COMMUNITIES Kanvas Biosciences, Inc. 2023-07-27 US claimed
EP-4152959-A1 HIGH-COMPLEXITY SYNTHETIC GUT BACTERIAL COMMUNITIES Chan Zuckerberg Biohub, Inc. (US) 2023-03-29 EP claimed
US-20220233611-A1 COMPOSITIONS AND METHODS FOR PROMOTING HEALTHY NEURAL DEVELOPMENT IN AN UNBORN BABY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-07-28 US claimed
EP-3965820-A1 COMPOSITIONS AND METHODS FOR PROMOTING HEALTHY NEURAL DEVELOPMENT IN AN UNBORN BABY The Regents of the University of California (US) 2022-03-16 EP claimed
US-20220050090-A1 MASS SPECTROMETRY ASSAY METHOD FOR DETECTION AND QUANTITATION OF MICROBIOTA RELATED METABOLITES METABOLON, INC. 2022-02-17 US claimed
WO-2021237162-A1 HIGH-COMPLEXITY SYNTHETIC GUT BACTERIAL COMMUNITIES CHAN ZUCKERBERG BIOHUB, INC. (US) 2021-11-25 WO claimed
US-20210353611-A1 METHODS OF TREATING AMYOTROPHIC LATERAL SCLEROSIS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2021-11-18 US claimed
EP-3852759-A2 METHODS OF TREATING AMYOTROPHIC LATERAL SCLEROSIS Yeda Research and Development Co. Ltd (IL) 2021-07-28 EP claimed
EP-3850359-A1 MASS SPECTROMETRY ASSAY METHOD FOR DETECTION AND QUANTITATION OF MICROBIOTA-RELATED METABOLITES Metabolon Inc. (US) 2021-07-21 EP claimed
US-20170306504-A1 CORROSION INHIBITOR COMPOSITIONS AND METHODS OF USING SAME CHAMPIONX LLC 2017-10-26 US 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
US-20150065366-A1 Biomarkers for Bladder Cancer and Methods Using the Same METABOLON, INC. 2015-03-05 US claimed
EP-2776832-A1 BIOMARKERS FOR BLADDER CANCER AND METHODS USING THE SAME Metabolon, Inc. (US) 2014-09-17 EP claimed
WO-2013070839-A1 BIOMARKERS FOR BLADDER CANCER AND METHODS USING THE SAME METABOLON, INC. (US) 2013-05-16 WO claimed
EP-1047391-A4 ALPHA-AMIDES OF L-AMINO ACIDS AS FRAGRANCE PRECURSORS GILLETTE CO (US) 2005-01-19 EP claimed
US-6238655-B1 USEFUL IN THE FORMULATION OF DEODORANTS, ANTIPERSPIRANTS, BODY SPRAYS, AND OTHER SKIN TREATMENT COMPOSITIONS. THE GILLETTE COMPANY 2001-05-29 US claimed
EP-1047391-A1 ALPHA-AMIDES OF L-AMINO ACIDS AS FRAGRANCE PRECURSORS THE GILLETTE COMPANY (US) 2000-11-02 EP claimed
WO-1999030679-A1 α-AMIDES OF L-AMINO ACIDS AS FRAGRANCE PRECURSORS THE GILLETTE COMPANY (US) 1999-06-24 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210353611-A1 METHODS OF TREATING AMYOTROPHIC LATERAL SCLEROSIS SMN1; SMN2, SOD1, OAT MME 200/4885ACE 1145/4885ERCC1 3681/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.