SCHEMBL7694261

SCHEMBL7694261

NCCCC[C@H](N)C(=O)NC(=O)N1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 8/20 0.44
DPP4 P27487 4/20 0.44
DPP8 Q6V1X1 3/20 0.44
ITGB3 P05106 2/20 0.44
ITGA2B P08514 2/20 0.44
DPP9 Q86TI2 2/20 0.44
GSR P00390 1/20 0.43
GNAI3 P08754 1/20 0.42
GNAO1 P09471 1/20 0.42
GNAI1 P63096 1/20 0.42
MEN1 O00255 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
FAP Q12884 1/20 0.41

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
SCHEMBL1821347 0.89 DPP7 (0.44) DPP7DPP4DPP8DPP9KMT2A
SCHEMBL3048734 0.86 GNAI3 (0.40) DPP7DPP4DPP8ITGB3ITGA2B
SCHEMBL6752685 0.79 DPP7 (0.62) DPP7DPP4DPP8ITGB3ITGA2B
SCHEMBL10434878 0.78 ITGB3 (0.39) ITGB3ITGA2B
SCHEMBL5499007 0.78 GSR (0.61) DPP7DPP4DPP8DPP9GSR
SCHEMBL7700261 0.78 PPID (0.38) DPP7
SCHEMBL29049118 0.77 DPP7 (0.64) DPP7DPP4DPP8ITGB3ITGA2B
SCHEMBL2694035 0.77 DPP7 (0.64) DPP7DPP4DPP8ITGB3ITGA2B
SCHEMBL5495401 0.76 GSR (0.59) DPP7DPP4DPP8DPP9GSR
SCHEMBL7301848 0.75 MMP1 (0.46) DPP7DPP4DPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002028829-A2 PEPTIDE DEFORMYLASE INHIBITORS QUESTCOR PHARMACEUTICALS, INC. (US) 2002-04-11 WO claimed