SCHEMBL3746015

SCHEMBL3746015

NC(=O)CC(C(N)=O)C(=O)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 1/20 0.44
HCAR2 Q8TDS4 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
SLC15A1 P46059 1/20 0.43
LTA4H P09960 1/20 0.43
LAP3 P28838 1/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL9403704 0.93 ALDH1A1 (0.52) ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3
SCHEMBL3746012 0.92 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3
SCHEMBL7345504 0.85 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3
SCHEMBL4027194 0.84 KMT2A (0.45) ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3
SCHEMBL11739098 0.82 ALDH1A1 (0.47) ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3
SCHEMBL27615767 0.82 ALDH1A1 (0.47) ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3
SCHEMBL14514418 0.81 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3
SCHEMBL7782945 0.81 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3
SCHEMBL7782947 0.81 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3
Hydrochloric Acid SCHEMBL30461727 0.80 SLC15A1 (0.49) ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12479838-B2 D3 receptor agonist compounds; methods of preparation; intermediates thereof; and methods of use thereof THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2025-11-25 US disclosed
US-20220220102-A1 D3 RECEPTOR AGONIST COMPOUNDS; METHODS OF PREPARATION; INTERMEDIATES THEREOF; AND METHODS OF USE THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2022-07-14 US disclosed
EP-3953350-A1 D3 RECEPTOR AGONIST COMPOUNDS; METHODS OF PREPARATION; INTERMEDIATES THEREOF; AND METHODS OF USE THEREOF The United States of America, as Represented by The Department of Health and Human Services (US) 2022-02-16 EP disclosed
US-20100286386-A1 Combinatorial production of nucleotide and nucleoside (XiTP) analogues INSTITUT PASTEUR 2010-11-11 US disclosed
US-7319148-B2 Combinatorial production of nucleotide and nucleoside (XiTP) analogues INSTITUT PASTEUR (FR) 2008-01-15 US disclosed
EP-1780214-A2 Combinatorial production of nucleotide and nucleoside analogues (XiTP) INSTITUT PASTEUR (FR) 2007-05-02 EP disclosed
EP-1290006-B1 Combinatorial production of nucleotide and nucleoside (XITP) analogues PASTEUR INSTITUT (FR) 2007-02-21 EP disclosed
EP-1140909-B1 NOVEL INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE SCHERING CORP (US) 2005-07-06 EP disclosed
US-20040023240-A1 Combinatorial production of nucleotide and nucleoside(xitp)analogues CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2004-02-05 US disclosed
EP-1290006-A1 COMBINATORIAL PRODUCTION OF NUCLEOTIDE AND NUCLEOSIDE (XITP)ANALOGUES INSTITUT PASTEUR (FR) 2003-03-12 EP disclosed
US-6432959-B1 ANTITUMOR AGENTS SCHERING CORPORATION 2002-08-13 US disclosed
WO-2001096354-A1 COMBINATORIAL PRODUCTION OF NUCLEOTIDE AND NUCLEOSIDE (XITP)ANALOGUES INSTITUT PASTEUR (FR) 2001-12-20 WO disclosed
EP-1140909-A1 NOVEL INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE SCHERING CORPORATION (US) 2001-10-10 EP disclosed
WO-2000039119-A1 NOVEL INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE SCHERING CORPORATION (US) 2000-07-06 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 (4 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-20220220102-A1 D3 RECEPTOR AGONIST COMPOUNDS; METHODS OF PREPARATION; INTERMEDIATES THEREOF; AND METHODS OF USE THEREOF DRD3, ADRB3, VDR ALDH1A1 2173/4885MAPK1 3752/4885L3MBTL1 2037/4885
US-20040023240-A1 Combinatorial production of nucleotide and nucleoside(xitp)analogues TYMP, PNP, DPYD ALDH1A1 1635/4885MAPK1 517/4885L3MBTL1 2891/4885
US-12479838-B2 D3 receptor agonist compounds; methods of preparation; intermediates thereof; and methods of use thereof DRD3, ADRB3, VDR ALDH1A1 2173/4885MAPK1 3752/4885L3MBTL1 2037/4885
US-20100286386-A1 Combinatorial production of nucleotide and nucleoside (XiTP) analogues TYMP, PNP, DPYD ALDH1A1 2422/4885MAPK1 998/4885L3MBTL1 3280/4885

“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.