SCHEMBL4275067

SCHEMBL4275067

NCC(=O)N1CCC[C@H]1C(=O)N([N+]=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.46
DPP8 Q6V1X1 2/20 0.46
DPP7 Q9UHL4 1/20 0.46
CPT2 P23786 1/20 0.40
CPT1A P50416 1/20 0.40
ACE P12821 2/20 0.40
PREP P48147 3/20 0.39
FAP Q12884 1/20 0.39
DPP9 Q86TI2 1/20 0.39
CHRM3 P20309 2/20 0.38
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM1 P11229 1/20 0.38
HTR1A P08908 2/20 0.37
HTR7 P34969 2/20 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
SCHEMBL8182012 0.81 ACE (0.44) DPP4DPP8DPP7ACEPREP
SCHEMBL15778534 0.79 DPP4 (0.44) DPP4DPP8DPP7CPT2CPT1A
SCHEMBL11267262 0.73 DPP4 (0.45) DPP4DPP8DPP7ACE
Hydrochloric Acid SCHEMBL11279921 0.72 DPP4 (0.45) DPP4DPP8DPP7ACE
SCHEMBL14311868 0.71 PREP (0.50) DPP4DPP8DPP7CPT2CPT1A
Hydrochloric Acid SCHEMBL10974126 0.71 CPT2 (0.48) DPP4DPP8DPP7CPT2CPT1A
SCHEMBL8772871 0.70 DPP4 (0.56) DPP4DPP8ACEPREPFAP
Glycyl Proline SCHEMBL155067 0.70 ACE (0.62) DPP4DPP8ACEPREPFAP
Glycyl Proline SCHEMBL30051559 0.70 ACE (0.62) DPP4DPP8ACEPREPFAP
SCHEMBL8772866 0.70 DPP4 (0.56) DPP4DPP8ACEPREPFAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009152186-A1 METHODS FOR ENHANCING CELL THERAPY EFFICACY INCLUDING TREATMENT WITH CD26 PEPTIDASE INHIBITORS AMERICAN STEM CELL, INC. (US) 2009-12-17 WO disclosed
EP-1553937-A4 GLYCINENITRILE-BASED INHIBITORS OF DIPEPTIDYL PEPTIDASE IV AND METHODS BRISTOL MYERS SQUIBB CO (US) 2006-07-19 EP disclosed
EP-1553937-A2 GLYCINENITRILE-BASED INHIBITORS OF DIPEPTIDYL PEPTIDASE IV AND METHODS Bristol-Myers Squibb Company (US) 2005-07-20 EP disclosed
WO-2004037181-A2 GLYCINENITRILE-BASED INHIBITORS OF DIPEPTIDYL PEPTIDASE IV AND METHODS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-05-06 WO disclosed
WO-1999047152-A2 USE OF DIPEPTIDYL PEPTIDASE (DPP4) OF FIBROBLAST ACTIVATING PROTEIN ALPHA FOR SUPPRESSING THE MALIGNANT PHENOTYPE OF CANCER CELLS SLOAN KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1999-09-23 WO disclosed