SCHEMBL5438409

SCHEMBL5438409

CCN(CC)C(=O)C(C)N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.42
LMNA P02545 1/20 0.39
ALDH1A1 P00352 2/20 0.38
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
MMP8 P22894 1/20 0.37
HTT P42858 2/20 0.36
HTR1A P08908 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 1/20 0.33
SLC15A1 P46059 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA9 Q16790 1/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 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
SCHEMBL3948078 1.00 DPP4 (0.42) DPP4LMNAALDH1A1MMP1MMP2
SCHEMBL5769336 0.85 DPP4 (0.35) DPP4LMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5769339 0.85 DPP4 (0.35) DPP4LMNAALDH1A1HTTSMN1; SMN2
SCHEMBL15995187 0.84 DPP4 (0.37) DPP4LMNAALDH1A1MMP1MMP2
SCHEMBL19170142 0.81 DPP4 (0.39) DPP4LMNA
SCHEMBL9873959 0.80 CA12 (0.44) DPP4LMNAALDH1A1SLC15A1CA12
SCHEMBL1619585 0.80 DPP4 (0.47) DPP4LMNAALDH1A1MMP1MMP2
SCHEMBL6201950 0.80 CA12 (0.44) DPP4LMNAALDH1A1SLC15A1CA12
SCHEMBL1619583 0.80 DPP4 (0.47) DPP4LMNAALDH1A1MMP1MMP2
Hydrochloric Acid SCHEMBL19136969 0.80 DPP4 (0.38) DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070161633-A1 4-Bromo-5-(2-chloro-benzoylamino)-1h-pyrazole-3-carboxylic acid (1-aminocarbonyl)eth-1-yl) amide derivatives and related compounds as bradykinin b1 receptor antagonists for the treatment of inflammatory diseases ELAN PHARMACEUTICALS, INC. (US) 2007-07-12 US claimed
EP-0794827-B1 NEW BUFFER SYSTEM FOR ELECTROPHORESIS AND USE THEREOF AMERSHAM BIOSCIENCES AB (SE) 2002-07-10 EP claimed
US-6090252-A NO ARTIFICIAL EXTRA BANDS DURING ELECTROPHORETIC SEPARATION BUT SHARP AND WELL-DEFINED BANDS OF MACROMOLECULES, E.G. PROTEINS, RESULT; GEL BUFFER SOLUTION CONTAINS A BASE AND TITRATING ACID, CATHODE ONE A WEAK ACID; STORAGE STABILITY PHARMACIA BIOTECH AB (SE) 2000-07-18 US claimed
EP-0794827-A1 NEW BUFFER SYSTEM FOR ELECTROPHORESIS AND USE THEREOF Pharmacia Biotech AB (SE) 1997-09-17 EP claimed
WO-1996016724-A1 NEW BUFFER SYSTEM FOR ELECTROPHORESIS AND USE THEREOF PHARMACIA BIOTECH AB (SE) 1996-06-06 WO claimed
EP-3013805-B1 SULFOXIMINE SUBSTITUTED QUINAZOLINES AND THEIR USE AS MNK1 AND/OR MNK2 KINASE INHIBITORS EVOTEC INT GMBH (DE) 2018-02-21 EP disclosed
US-8927292-B2 Methods of evaluating peptide mixtures MOMENTA PHARMACEUTICALS, INC. (US) 2015-01-06 US disclosed
US-8921116-B2 Methods of evaluating diethylamide in peptide mixtures for the preparation of glatiramer acetate MOMENTA PHARMACEUTICALS, INC. (US) 2014-12-30 US disclosed
US-20140080218-A1 METHODS OF EVALUATING PEPTIDE MIXTURES Momenta Phamaceuticals, Inc. (US) 2014-03-20 US disclosed
CN-101959516-B Combination therapy comprising quinoxaline PI3K alpha inhibitors for the treatment of cancer EXELIXIS INC 2013-05-08 CN disclosed
CN-101959516-A Combination therapy comprising quinoxaline PI3K alpha inhibitors for the treatment of cancer EXELIXIS INC 2011-01-26 CN disclosed
US-20070161633-A1 4-Bromo-5-(2-chloro-benzoylamino)-1h-pyrazole-3-carboxylic acid (1-aminocarbonyl)eth-1-yl) amide derivatives and related compounds as bradykinin b1 receptor antagonists for the treatment of inflammatory diseases ELAN PHARMACEUTICALS, INC. (US) 2007-07-12 US disclosed
EP-1633349-A1 4-BROMO-5- (2-CHLORO-BENZOYLAMINO)-1H-PYRAZOLE-3-CARBOXYLIC ACID (1-(AMINOCARBONYL) ETH-1-YL) AMIDE DERIVATIVES AND RELATED COMPOUNDS AS BRADYKININ B1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES Elan Pharmaceuticals, Inc. (US) 2006-03-15 EP disclosed
US-20050038099-A1 Substituted pyrazole derivatives and related compounds as bradykinin B1 receptor antagonists ELAN PHARMACEUTICALS, INC. 2005-02-17 US disclosed
WO-2004098590-A1 4-BROMO-5- (2-CHLORO-BENZOYLAMINO)-1H-PYRAZOLE-3-CARBOXYLIC ACID (1-(AMINOCARBONYL) ETH-1-YL) AMIDE DERIVATIVES AND RELATED COMPOUNDS AS BRADYKININ B1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES ELAN PHARMACEUTICALS, INC. (US) 2004-11-18 WO disclosed
EP-0794827-B1 NEW BUFFER SYSTEM FOR ELECTROPHORESIS AND USE THEREOF AMERSHAM BIOSCIENCES AB (SE) 2002-07-10 EP disclosed
US-6090252-A NO ARTIFICIAL EXTRA BANDS DURING ELECTROPHORETIC SEPARATION BUT SHARP AND WELL-DEFINED BANDS OF MACROMOLECULES, E.G. PROTEINS, RESULT; GEL BUFFER SOLUTION CONTAINS A BASE AND TITRATING ACID, CATHODE ONE A WEAK ACID; STORAGE STABILITY PHARMACIA BIOTECH AB (SE) 2000-07-18 US disclosed
EP-0794827-A1 NEW BUFFER SYSTEM FOR ELECTROPHORESIS AND USE THEREOF Pharmacia Biotech AB (SE) 1997-09-17 EP disclosed
WO-1996016724-A1 NEW BUFFER SYSTEM FOR ELECTROPHORESIS AND USE THEREOF PHARMACIA BIOTECH AB (SE) 1996-06-06 WO disclosed
US-5026711-A Prevention and treatment of cardiovascular disorders and infections states; anxiolytic and anti-allergic agents SANOFI (FR) 1991-06-25 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-20050038099-A1 Substituted pyrazole derivatives and related compounds as bradykinin B1 receptor antagonists BDKRB1, BDKRB2, BRS3 DPP4 1666/4885LMNA 1562/4885ALDH1A1 3054/4885
US-20070161633-A1 4-Bromo-5-(2-chloro-benzoylamino)-1h-pyrazole-3-carboxylic acid (1-aminocarbonyl)eth-1-yl) amide derivatives and related compounds as bradykinin b1 receptor antagonists for the treatment of inflammatory diseases BDKRB1, BDKRB2, HRH2 DPP4 3279/4885LMNA 1239/4885ALDH1A1 1736/4885

“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.