SCHEMBL5794922

SCHEMBL5794922

O=CC(=O)N1CCC(O)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.41
DPP7 Q9UHL4 2/20 0.41
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM1 P11229 1/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
PDK2 Q15119 1/20 0.34
GRM5 P41594 1/20 0.33
VNN1 O95497 1/20 0.33
ADAM10 O14672 1/20 0.32
ERBB2 P04626 1/20 0.32
MMP2 P08253 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
SCHEMBL5794923 1.00 DPP4 (0.41) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL14562577 0.86 NPC1 (0.39) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL18615557 0.81 DPP4 (0.40) DPP4DPP7
SCHEMBL20893428 0.81 DPP4 (0.40) DPP4DPP7
SCHEMBL22826051 0.81 DPP4 (0.44) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL13451855 0.81 DPP4 (0.40) DPP4DPP7
SCHEMBL14655428 0.81 DPP4 (0.44) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL14655504 0.78 DPP4 (0.41) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL27811427 0.77 DPP4 (0.46) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL27790232 0.77 DPP4 (0.46) DPP4DPP7CHRM2CHRM4CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1545528-A4 INDOLE-TYPE DERIVATIVES AS INHIBITORS OF P38 KINASE SCIOS INC (US) 2006-07-26 EP disclosed
EP-1545528-A2 INDOLE-TYPE DERIVATIVES AS INHIBITORS OF P38 KINASE SCIOS INC. (US) 2005-06-29 EP disclosed
WO-2004022712-A2 INDOLE-TYPE DERIVATIVES AS INHIBITORS OF p38 KINASE SCIOS INC. (US) 2004-03-18 WO disclosed