SCHEMBL7142602

SCHEMBL7142602

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
ANPEP P15144 2/20 0.44
RNPEP Q9H4A4 2/20 0.44
DNPEP Q9ULA0 1/20 0.44
SLC7A5 Q01650 1/20 0.42
LTA4H P09960 1/20 0.40
LAP3 P28838 3/20 0.37
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
THRB P10828 1/20 0.35
ALOX15 P16050 1/20 0.35
NFKB1 P19838 1/20 0.35
PTGS2 P35354 1/20 0.35
THPO P40225 1/20 0.35
RECQL P46063 1/20 0.35
BLM P54132 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL1901280 1.00 ALDH1A1 (0.55) ALDH1A1ANPEPRNPEPDNPEPSLC7A5
SCHEMBL7100850 0.81 SLC7A5 (0.61) ALDH1A1ANPEPRNPEPDNPEPSLC7A5
SCHEMBL530834 0.81 SLC7A5 (0.61) ALDH1A1ANPEPRNPEPDNPEPSLC7A5
Levacetylleucine SCHEMBL18283362 0.77 ALDH1A1 (0.79) ALDH1A1SLC7A5LTA4HLAP3MEN1
Acetylleucine SCHEMBL20898469 0.77 ALDH1A1 (0.79) ALDH1A1SLC7A5LTA4HLAP3MEN1
SCHEMBL14771687 0.74 ALDH1A1 (0.62) ALDH1A1LTA4HLAP3MEN1LMNA
SCHEMBL15810880 0.74 ALDH1A1 (0.67) ALDH1A1LAP3MEN1LMNAKMT2A
SCHEMBL7669779 0.74 ALDH1A1 (0.67) ALDH1A1LAP3MEN1LMNAKMT2A
SCHEMBL7669784 0.74 ALDH1A1 (0.67) ALDH1A1LAP3MEN1LMNAKMT2A
SCHEMBL13822102 0.73 ALDH1A1 (0.72) ALDH1A1LAP3MEN1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9889102-B2 Sigma receptor ligands and methods of modulating cellular protein homeostasis using same DREXEL UNIVERSITY (US) 2018-02-13 US claimed
US-20160361279-A1 NOVEL SIGMA RECEPTOR LIGANDS AND METHODS OF MODULATING CELLULAR PROTEIN HOMEOSTASIS USING SAME Philadelphia Health And Education Corporation, d/b/a Drexel University College of Medicine 2016-12-15 US claimed
EP-1030917-A1 TRANSCRIPTIONALLY REGULATED G PROTEIN-COUPLED RECEPTOR THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-08-30 EP claimed
WO-1999025830-A1 TRANSCRIPTIONALLY REGULATED G PROTEIN-COUPLED RECEPTOR THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-05-27 WO claimed
US-12398108-B2 Compounds, compositions, and methods for treating diseases DREXEL UNIVERSITY (US) 2025-08-26 US disclosed
US-20240366741-A1 NOVEL VACCINE FORMULATIONS FOR MYCOBACTERIUM TUBERCULOSIS AND USE OF THEREOF PURDUE RESEARCH FOUNDATION (US) 2024-11-07 US disclosed
US-20230416206-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING DISEASES UNIV DREXEL (US) 2023-12-28 US disclosed
WO-2022192163-A1 NOVEL VACCINE FORMULATIONS FOR MYCOBACTERIUM TUBERCULOSIS AND USE OF THEREOF PURDUE RESEARCH FOUNDATION (US) 2022-09-15 WO disclosed
US-20220001014-A1 COMPOSITIONS AND METHODS FOR INDUCING BIOLOGICAL MIMICRY IN A MAMMAL FOR THE PREVENTION AND/OR TREATMENT OF COVID-19 AND OTHER DISEASES GHADERI LIDA (US) 2022-01-06 US disclosed
US-20210403436-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING DISEASES UNIV DREXEL (US) 2021-12-30 US disclosed
US-11117870-B2 Compounds, compositions, and methods for treating diseases DREXEL UNIVERSITY (US) 2021-09-14 US disclosed
US-20200339519-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING DISEASES DREXEL UNIVERSITY (US) 2020-10-29 US disclosed
EP-2819665-A1 PROTEASE INHIBITORS FOR TREATING TRICHOMONAS GALLINAE INFECTIONS Veterinärmedizinische Universität Wien (AT) 2015-01-07 EP disclosed
WO-2013127981-A1 PROTEASE INHIBITORS FOR TREATING TRICHOMONAS GALLINAE INFECTIONS VETERINÄRMEDIZINISCHE UNIVERSITÄT WIEN (AT) 2013-09-06 WO disclosed
US-6514696-B1 Detection thereof; Using polynucleotide that hybridizes to given nucleotide sequence; Cancer THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-02-04 US disclosed
US-6383760-B1 CONTACTING RECEPTOR WITH TEST COMPOUND, THEN DETERMINING IF COMPOUND BINDS TO RECEPTOR THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2002-05-07 US disclosed
WO-2001081918-A1 TRANSCRIPTIONALLY REGULATED G PROTEIN-COUPLED RECEPTOR G2A THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2001-11-01 WO disclosed
US-6214562-B1 DETECTING LIGANDS WHICH PREFERENTIALY BIND CONTROLLING PROTEINS; INCUBATE BINDING PROTEIN WITH LIGAND AND DETECT BINDING THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2001-04-10 US disclosed
EP-1030917-A1 TRANSCRIPTIONALLY REGULATED G PROTEIN-COUPLED RECEPTOR THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-08-30 EP disclosed
WO-1999025830-A1 TRANSCRIPTIONALLY REGULATED G PROTEIN-COUPLED RECEPTOR THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-05-27 WO disclosed

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

For each of this compound's patents that has machine-readable text (6 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-20200339519-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING DISEASES SIGMAR1, OPRK1, OPRM1 ALDH1A1 464/4885ANPEP 3428/4885RNPEP 2191/4885
US-11117870-B2 Compounds, compositions, and methods for treating diseases SIGMAR1, OPRK1, OPRM1 ALDH1A1 464/4885ANPEP 3428/4885RNPEP 2191/4885
US-12398108-B2 Compounds, compositions, and methods for treating diseases SIGMAR1, OPRK1, OPRM1 ALDH1A1 252/4885ANPEP 3760/4885RNPEP 2622/4885
US-20210403436-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING DISEASES SIGMAR1, OPRL1, NR1H3 ALDH1A1 678/4885ANPEP 3459/4885RNPEP 2289/4885
US-20160361279-A1 NOVEL SIGMA RECEPTOR LIGANDS AND METHODS OF MODULATING CELLULAR PROTEIN HOMEOSTASIS USING SAME TMEM97, SIGMAR1, ADRM1 ALDH1A1 3691/4885ANPEP 3680/4885RNPEP 3508/4885
US-20230416206-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING DISEASES SIGMAR1, OPRK1, OPRM1 ALDH1A1 252/4885ANPEP 3760/4885RNPEP 2622/4885

“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.