SCHEMBL4530422

SCHEMBL4530422

Nc1ccc2c(c1)N=CC(C(=O)O)C2=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
CASP1 P29466 3/20 0.33
HSD17B10 Q99714 3/20 0.33
GAA P10253 2/20 0.33
ALDH1A1 P00352 4/20 0.33
CYP3A4 P08684 3/20 0.33
TDP1 Q9NUW8 3/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
CSNK2A1 P68400 1/20 0.32
CSNK2A3 Q8NEV1 1/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL1444909 0.77 MAPT (0.38) MEN1KMT2ACASP1HSD17B10ALDH1A1
SCHEMBL8597444 0.72 HRH4 (0.39)
SCHEMBL2403993 0.67 ALDH1A1 (0.33) MEN1KMT2ACASP1HSD17B10GAA
SCHEMBL7081619 0.66 CES2 (0.31)
SCHEMBL29031416 0.65 NPC1 (0.41) MEN1KMT2ACASP1HSD17B10GAA
SCHEMBL11555181 0.65 CES1 (0.31)
SCHEMBL10965303 0.62
SCHEMBL940449 0.61 ALDH1A1 (0.39) MEN1KMT2ACASP1HSD17B10GAA
SCHEMBL8534521 0.61 CASP1 (0.43) MEN1KMT2ACASP1HSD17B10GAA
SCHEMBL6783904 0.60 CDC25B (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7498341-B2 antidiabetic agents; type 2 diabetes SANOFI AVENTIS DEUTSCHLAND GMBH (DE) 2009-03-03 US disclosed
US-7498341-B2 antidiabetic agents; type 2 diabetes SANOFI AVENTIS DEUTSCHLAND GMBH (DE) 2009-03-03 US disclosed
US-7498341-B2 antidiabetic agents; type 2 diabetes SANOFI AVENTIS DEUTSCHLAND GMBH (DE) 2009-03-03 US disclosed
US-7470706-B2 Cycloalkyl-substituted 7-amino-4-quinolone-3-carboxylic acid derivatives, process for their preparation and their use as medicaments SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-12-30 US disclosed
US-7470706-B2 Cycloalkyl-substituted 7-amino-4-quinolone-3-carboxylic acid derivatives, process for their preparation and their use as medicaments SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-12-30 US disclosed
US-7470706-B2 Cycloalkyl-substituted 7-amino-4-quinolone-3-carboxylic acid derivatives, process for their preparation and their use as medicaments SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-12-30 US disclosed
EP-1713804-B1 CYCLOALKYL SUBSTITUTED 7-AMINO-4-QUINOLONE-3-CARBOXYLIC ACID DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS SANOFI AVENTIS DEUTSCHLAND (DE) 2008-03-19 EP disclosed
EP-1720870-B1 HETEROCYCLICALLY SUBSTITUTED 7-AMINO-4-QUINOLONE-3-CARBOXYLIC ACID DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS SANOFI AVENTIS DEUTSCHLAND (DE) 2007-08-22 EP disclosed
CN-1910182-A Cycloalkyl-substituted 7-amino-4-quinolone-3-carboxylic acid derivatives, process for their preparation and their use as medicaments AVENTIS PHARMA GMBH (DE) 2007-02-07 CN disclosed
CN-1910182-A Cycloalkyl-substituted 7-amino-4-quinolone-3-carboxylic acid derivatives, process for their preparation and their use as medicaments AVENTIS PHARMA GMBH (DE) 2007-02-07 CN disclosed
EP-1720870-A1 HETEROCYCLICALLY SUBSTITUTED 7-AMINO-4-QUINOLONE-3-CARBOXYLIC ACID DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS Sanofi-Aventis Deutschland GmbH (DE) 2006-11-15 EP disclosed
EP-1713804-A1 CYCLOALKYL SUBSTITUTED 7-AMINO-4-QUINOLONE-3-CARBOXYLIC ACID DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS Sanofi-Aventis Deutschland GmbH (DE) 2006-10-25 EP disclosed
US-20050182087-A1 Cycloalkyl-substituted 7-amino-4-quinolone-3-carboxylic acid derivatives, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-08-18 US disclosed
US-20050182087-A1 Cycloalkyl-substituted 7-amino-4-quinolone-3-carboxylic acid derivatives, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-08-18 US disclosed
US-20050182087-A1 Cycloalkyl-substituted 7-amino-4-quinolone-3-carboxylic acid derivatives, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-08-18 US disclosed
US-20050182086-A1 antidiabetic agents; type 2 diabetes AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-08-18 US disclosed
US-20050182086-A1 antidiabetic agents; type 2 diabetes AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-08-18 US disclosed
US-20050182086-A1 antidiabetic agents; type 2 diabetes AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-08-18 US disclosed
WO-2005073230-A1 HETEROCYCLICALLY SUBSTITUTED 7-AMINO-4-QUINOLONE-3-CARBOXYLIC ACID DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-08-11 WO disclosed
WO-2005073231-A1 CYCLOALKYL SUBSTITUTED 7-AMINO-4-QUINOLONE-3-CARBOXYLIC ACID DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-08-11 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 (2 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-20050182086-A1 antidiabetic agents; type 2 diabetes SLC5A2, SLC5A1, SLC2A2 MEN1 2746/4885KMT2A 2936/4885CASP1 1743/4885
US-20050182087-A1 Cycloalkyl-substituted 7-amino-4-quinolone-3-carboxylic acid derivatives, process for their preparation and their use as medicaments SLC5A2, QPCT, GLS MEN1 3823/4885KMT2A 3783/4885CASP1 973/4885

“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.