SCHEMBL5708588

SCHEMBL5708588

CSCC[C@H](N)C(=O)NCC(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
EPHX2 P34913 1/20 0.42
NAMPT P43490 1/20 0.40
MMP2 P08253 5/20 0.40
ALDH1A1 P00352 2/20 0.39
TACR1 P25103 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
MMP9 P14780 1/20 0.39
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
NPC1 O15118 1/20 0.38
PABPC1 P11940 1/20 0.38
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL6417819 0.88 LMNA (0.46) LMNAEPHX2NAMPTMMP2ALDH1A1
SCHEMBL5708580 0.85 FKBP4 (0.47) TACR1
SCHEMBL29543700 0.78 ALDH1A1 (0.49) ALDH1A1KMT2AMEN1NPC1MAPK1
SCHEMBL379486 0.77 NAMPT (0.53) LMNAEPHX2NAMPTMMP2ALDH1A1
SCHEMBL4372297 0.77 NAMPT (0.53) LMNAEPHX2NAMPTMMP2ALDH1A1
SCHEMBL18509855 0.77 NAMPT (0.53) LMNAEPHX2NAMPTMMP2ALDH1A1
SCHEMBL30051290 0.77 ACE (0.43) LMNAMMP2DPP4
Hydrochloric Acid SCHEMBL29692756 0.77 ALDH1A1 (0.48) ALDH1A1KMT2AMEN1NPC1MAPK1
SCHEMBL30610198 0.77 ALDH1A1 (0.50) LMNANAMPTMMP2ALDH1A1KMT2A
SCHEMBL5501196 0.77 TACR1 (0.44) LMNAMMP2TACR1MMP9DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1221954-B1 METHODS FOR IDENTIFYING INHIBITORS OF METHIONINE AMINOPEPTIDASES UNIV SAINT LOUIS (US) 2006-09-13 EP claimed
EP-1221954-A4 METHODS FOR IDENTIFYING INHIBITORS OF METHIONINE AMINOPEPTIDASES UNIV SAINT LOUIS (US) 2002-11-27 EP claimed
EP-1221954-A2 METHODS FOR IDENTIFYING INHIBITORS OF METHIONINE AMINOPEPTIDASES Saint Louis University (US) 2002-07-17 EP claimed
US-20010047078-A1 Methods for identifying inhibitors of methionine aminopeptidases SAINT LOUIS UNIVERSITY 2001-11-29 US claimed
US-6261794-B1 COMBINING A SAMPLE WITH A N-TERMINAL METHIONINE PEPTIDE AND A SECOND PEPTIDE WITH A C-TERMINAL DETECTION MOIETY THAT IS RELEASED BY A SECOND PEPTIDASE ONLY IF THE N-TERMINAL PEPTIDE HAS BEEN CLEAVED BY METHIONINE AMINOPEPTIDASE SAINT LOUIS UNIVERSITY 2001-07-17 US claimed
WO-2001027242-A2 METHODS FOR IDENTIFYING INHIBITORS OF METHIONINE AMINOPEPTIDASES SAINT LOUIS UNIVERSITY (US) 2001-04-19 WO claimed
EP-1221954-B1 METHODS FOR IDENTIFYING INHIBITORS OF METHIONINE AMINOPEPTIDASES UNIV SAINT LOUIS (US) 2006-09-13 EP disclosed
US-6593454-B2 Combining composition to be tested with peptide comprising an N-terminal methionine under conditions that N-terminal methionine is cleaved from peptide by methionine aminopeptidase SAINT LOUIS UNIVERSITY 2003-07-15 US disclosed
EP-1221954-A4 METHODS FOR IDENTIFYING INHIBITORS OF METHIONINE AMINOPEPTIDASES UNIV SAINT LOUIS (US) 2002-11-27 EP disclosed
EP-1221954-A2 METHODS FOR IDENTIFYING INHIBITORS OF METHIONINE AMINOPEPTIDASES Saint Louis University (US) 2002-07-17 EP disclosed
US-20010047078-A1 Methods for identifying inhibitors of methionine aminopeptidases SAINT LOUIS UNIVERSITY 2001-11-29 US disclosed
US-6261794-B1 COMBINING A SAMPLE WITH A N-TERMINAL METHIONINE PEPTIDE AND A SECOND PEPTIDE WITH A C-TERMINAL DETECTION MOIETY THAT IS RELEASED BY A SECOND PEPTIDASE ONLY IF THE N-TERMINAL PEPTIDE HAS BEEN CLEAVED BY METHIONINE AMINOPEPTIDASE SAINT LOUIS UNIVERSITY 2001-07-17 US disclosed
WO-2001027242-A2 METHODS FOR IDENTIFYING INHIBITORS OF METHIONINE AMINOPEPTIDASES SAINT LOUIS UNIVERSITY (US) 2001-04-19 WO disclosed