SCHEMBL15082007

SCHEMBL15082007

CC(C)(C)OC(=O)NC12CCC3CC3(CN(C(=O)OCc3ccccc3)C1)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 2/20 0.40
DPP9 Q86TI2 2/20 0.40
PDE4B Q07343 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
CYP2C19 P33261 1/20 0.39
CTSL P07711 1/20 0.38
SYK P43405 1/20 0.37
RORC P51449 2/20 0.37
ENPP2 Q13822 1/20 0.37
ATXN2 Q99700 1/20 0.37
KMT2A Q03164 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GRIN2B Q13224 1/20 0.36
MEN1 O00255 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
YAP1 P46937 1/20 0.36
STS P08842 1/20 0.36

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
SCHEMBL19748028 0.80 DPP8 (0.46) DPP8DPP9PDE4BHTTSMN1; SMN2
SCHEMBL4749330 0.80 HTT (0.41) PDE4BHTTSMN1; SMN2NPC1RAB9A
SCHEMBL14828963 0.79 SYK (0.46) PDE4BHTTSMN1; SMN2NPC1RAB9A
SCHEMBL30829116 0.78 KMT2A (0.41) DPP8DPP9PDE4BHTTSMN1; SMN2
SCHEMBL3489421 0.78 DPP8 (0.41) DPP8DPP9PDE4BHTTSMN1; SMN2
SCHEMBL31076386 0.78 KMT2A (0.41) DPP8DPP9PDE4BHTTSMN1; SMN2
SCHEMBL31085684 0.78 PDE4B (0.44) DPP8DPP9PDE4BHTTSMN1; SMN2
SCHEMBL31085683 0.78 PDE4B (0.44) DPP8DPP9PDE4BHTTSMN1; SMN2
SCHEMBL15082017 0.77 PDE4B (0.41) DPP8DPP9PDE4BHTTSMN1; SMN2
SCHEMBL2670198 0.77 PDE4B (0.41) DPP8DPP9PDE4BHTTSMN1; SMN2

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-2097400-B1 FUSED SUBSTITUTED AMINOPYRROLIDINE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2013-07-03 EP disclosed