SCHEMBL7700262

SCHEMBL7700262

CSCC[C@H](N)C(=O)C1CCCCN1C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
DPP7 Q9UHL4 6/20 0.36
DPP4 P27487 5/20 0.34
LMNA P02545 1/20 0.34
DPP8 Q6V1X1 3/20 0.34
FAP Q12884 2/20 0.33
DPP9 Q86TI2 2/20 0.33
ACE P12821 2/20 0.33
REN P00797 1/20 0.33
FKBP1A P62942 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
SCHEMBL7694263 0.80 DPP7 (0.54) DPP7DPP4DPP8FAPDPP9
SCHEMBL6234774 0.79 ARG1 (0.35) DPP7DPP4LMNA
SCHEMBL6234770 0.79 ARG1 (0.35) DPP7DPP4LMNA
SCHEMBL30819305 0.77 DPP4 (0.46) DPP7DPP4DPP8FAPDPP9
Bromide SCHEMBL7271475 0.76 DPP4 (0.45) DPP7DPP4DPP8FAPDPP9
SCHEMBL9725095 0.74 ACE (0.55) DPP7DPP4LMNADPP8FAP
SCHEMBL9725100 0.74 ACE (0.55) DPP7DPP4LMNADPP8FAP
SCHEMBL7699816 0.74 DPP4 (0.44) DPP7DPP4DPP8FAPDPP9
SCHEMBL7694794 0.70 DPP4 (0.54) DPP4ACE
SCHEMBL30051953 0.70 ACE (0.50) DPP4LMNAACEREN

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