SCHEMBL4595765

SCHEMBL4595765

CC(C)COC(=O)N1CCC(O)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.48
RAB9A P51151 1/20 0.48
HSD11B1 P28845 1/20 0.44
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
DPP7 Q9UHL4 2/20 0.41
GAA P10253 1/20 0.39
POLB P06746 1/20 0.38
NOS3 P29474 1/20 0.38
NOS2 P35228 1/20 0.38
GPR119 Q8TDV5 2/20 0.38
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
PIK3CD O00329 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
KIT P10721 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
SCHEMBL6420173 0.90 RAB9A (0.52) DPP4RAB9AHSD11B1JAK2JAK1
SCHEMBL794087 0.90 RAB9A (0.50) DPP4RAB9AHSD11B1JAK2JAK1
SCHEMBL3712535 0.89 RAB9A (0.48) DPP4RAB9AHSD11B1JAK2JAK1
SCHEMBL1692767 0.86 RAB9A (0.45) RAB9AHSD11B1JAK2JAK1POLB
SCHEMBL6964671 0.86 RAB9A (0.44) DPP4RAB9AHSD11B1JAK2JAK1
SCHEMBL3718960 0.84 RAB9A (0.52) RAB9AHSD11B1JAK2JAK1PRMT5
SCHEMBL24131326 0.83 RAB9A (0.48) DPP4RAB9AHSD11B1JAK2JAK1
SCHEMBL2978403 0.82 GAA (0.56) DPP4GAAPOLBNOS3NOS2
SCHEMBL701943 0.82 GAA (0.56) DPP4GAAPOLBNOS3NOS2
SCHEMBL3400107 0.82 RAB9A (0.47) DPP4RAB9AHSD11B1JAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1874768-A2 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2008-01-09 EP disclosed
WO-2006113837-A2 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2006-10-26 WO disclosed