SCHEMBL8820929

SCHEMBL8820929

CC(C)(C)OC(=O)N1CCC(CCCc2nc(-c3cccc(O)c3)no2)CC1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 7/20 0.55
▸ FAAH O00519 1/20 0.46
▸ ABL1 P00519 1/20 0.45
▸ EGFR P00533 1/20 0.45
▸ SRC P12931 1/20 0.45
▸ ABL2 P42684 1/20 0.45
▸ POLB P06746 1/20 0.44
▸ HDAC4 P56524 2/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ TGFBR1 P36897 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ CPT1A P50416 1/20 0.42

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
SCHEMBL8820974 0.87 GPR119 (0.49) GPR119FAAHCPT1A
SCHEMBL14924229 0.84 GPR119 (0.61) GPR119FAAHPOLBHDAC4KDM4E
SCHEMBL8820917 0.81 GPR119 (0.54) GPR119FAAHHDAC4
SCHEMBL390317 0.79 GPR119 (0.74) GPR119FAAHHDAC4KDM4EPKM
SCHEMBL15785127 0.79 GPR119 (0.62) GPR119FAAHPOLBHDAC4KDM4E
SCHEMBL3188476 0.79 GPR119 (0.46) GPR119HDAC4
SCHEMBL8820926 0.79 GPR119 (0.51) GPR119ABL1EGFRSRCABL2
SCHEMBL30812262 0.79 GPR119 (0.51) GPR119FAAHTGFBR1KDM4EPKM
SCHEMBL4414146 0.77 GPR119 (0.58) GPR119HDAC4KDM4EPKM
SCHEMBL4417372 0.76 GPR119 (0.57) GPR119HDAC4

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-1997044333-A1 1,2,4-OXADIAZOLES AS ADHESION-RECEPTOR ANTAGONISTS MERCK PATENT GMBH (DE) 1997-11-27 — — WO disclosed
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