SCHEMBL11200711

SCHEMBL11200711

CC(C)(C)OC(=O)C(N)CCN1CCN(CCCN)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
DPP7 Q9UHL4 3/20 0.35
DPP4 P27487 2/20 0.35
GSR P00390 1/20 0.34
HSD17B10 Q99714 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34
DRD2 P14416 4/20 0.33
HRH2 P25021 2/20 0.33
HRH1 P35367 2/20 0.33
USP2 O75604 1/20 0.33
SIGMAR1 Q99720 1/20 0.33

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
SCHEMBL4743247 0.84 L3MBTL1 (0.40) SMN1; SMN2
SCHEMBL19927629 0.80 KCNA3 (0.39) SMN1; SMN2DPP7DPP4
SCHEMBL11415211 0.80 GSR (0.44) DPP7DPP4GSRDPP8DPP9
SCHEMBL855007 0.80 GSR (0.44) DPP7DPP4GSRDPP8DPP9
SCHEMBL11415214 0.80 GSR (0.44) DPP7DPP4GSRDPP8DPP9
SCHEMBL31503050 0.79 MEN1 (0.39) SMN1; SMN2HRH2HRH1SIGMAR1
SCHEMBL31503051 0.79 MEN1 (0.39) SMN1; SMN2HRH2HRH1SIGMAR1
SCHEMBL855342 0.78 GSR (0.52) DPP7DPP4GSRDPP8DPP9
Hydrochloric Acid SCHEMBL11272393 0.78 GSR (0.42) DPP7DPP4GSRDPP8DPP9
SCHEMBL866977 0.78 GSR (0.52) DPP7DPP4GSRDPP8DPP9

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
EP-0087564-A1 Specific binding assay method, reagent system and labelled conjugate for use in this method MILES LABORATORIES, INC. (US) 1983-09-07 EP disclosed