SCHEMBL4537810

SCHEMBL4537810

Nc1ccc2c(=O)c(C(=O)O)c[nH]c2c1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.62
ALDH1A1 P00352 2/20 0.62
HPGD P15428 2/20 0.62
MEN1 O00255 1/20 0.62
ALOX12 P18054 1/20 0.62
KMT2A Q03164 1/20 0.62
KDM4E B2RXH2 1/20 0.55
HSD17B10 Q99714 1/20 0.55
MDH2 P40926 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
CSNK2A2 P19784 1/20 0.49
CSNK2B P67870 1/20 0.49
CSNK2A1 P68400 1/20 0.49

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
SCHEMBL28692077 0.90 F7 (0.50) CYP1A2ALDH1A1HPGDMEN1ALOX12
SCHEMBL11143666 0.87 KDM4E (0.68) CYP1A2ALDH1A1HPGDMEN1ALOX12
SCHEMBL18589525 0.82 CYP1A2 (0.64) CYP1A2ALDH1A1HPGDMEN1ALOX12
SCHEMBL30906941 0.81 F7 (0.66) CYP1A2ALDH1A1HPGDMEN1ALOX12
SCHEMBL30416773 0.81 KDM4E (0.77) CYP1A2ALDH1A1HPGDMEN1ALOX12
SCHEMBL2974546 0.81 ALDH1A1 (0.62) CYP1A2ALDH1A1HPGDMEN1ALOX12
SCHEMBL4452877 0.81 KDM4E (0.77) CYP1A2ALDH1A1HPGDMEN1ALOX12
SCHEMBL4342972 0.81 CYP1A2 (0.62) CYP1A2ALDH1A1HPGDMEN1ALOX12
SCHEMBL12786892 0.81 CYP1A2 (0.62) CYP1A2ALDH1A1HPGDMEN1ALOX12
SCHEMBL2965244 0.81 F7 (0.66) CYP1A2ALDH1A1HPGDMEN1ALOX12

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 26 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-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-1910181-A Heterocyclically 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
CN-1910181-A Heterocyclically 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
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
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
US-4404201-A N-/ /ALKANOYLAMINOALKANOYLAMINO OR AMINOALKANOYL AMINO/-DIHYDRO-OXO-3-QUINOLINYLCARBONYL/- DERIVATIVES WARNER-LAMBERT COMPANY (US) 1983-09-13 US disclosed
US-4382089-A Antibacterial amide compounds, compositions thereof and methods of using them WARNER-LAMBERT COMPANY (US) 1983-05-03 US disclosed
US-4137227-A BACTERICIDES STERLING DRUG INC. (US) 1979-01-30 US 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 CYP1A2 37/4885ALDH1A1 365/4885HPGD 436/4885
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 CYP1A2 35/4885ALDH1A1 623/4885HPGD 419/4885

“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.