SCHEMBL13876130

SCHEMBL13876130

CC(C)(C)OC(=O)N1CCN(c2nc(Cl)nc3c2[nH]c(=O)n3COC(=O)C(C)(C)C)CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIT P10721 2/20 0.35
DDR1 Q08345 2/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
ACHE P22303 1/20 0.34
PIK3CD O00329 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
DPP4 P27487 1/20 0.34
GBA1 P04062 2/20 0.33
GRIA1 P42261 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OGFRL1 Q5TC84 1/20 0.33
KCNH2 Q12809 1/20 0.33
TLR9 Q9NR96 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL3878672 0.82 KIT (0.40) KITCNR1CNR2PIK3CDMAPT
SCHEMBL13875676 0.78 TRAP1 (0.37) KDM4ENPSR1POLB
SCHEMBL3879335 0.77 NR1H2 (0.34) CNR1CNR2ACHEDPP4GBA1
SCHEMBL1695032 0.76 OPRM1 (0.42) KITCNR1CNR2PIK3CDOPRM1
SCHEMBL13876131 0.74 KIT (0.43) KITCNR1CNR2ACHEPIK3CD
SCHEMBL5719178 0.72 DCTPP1 (0.43) ACHEKDM4EMAPTTHRBOPRM1
SCHEMBL5719594 0.72 GAA (0.41) DPP4KCNH2SMN1; SMN2
SCHEMBL3873555 0.70 KIT (0.37) KITCNR1CNR2ACHEGBA1
SCHEMBL20011912 0.70 POLB (0.47) KITCNR1CNR2ACHEMAPT
SCHEMBL30060994 0.70 POLB (0.47) KITCNR1CNR2ACHEMAPT

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
US-7524847-B2 Fused 1,3-dihydro-imidazole ring compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-04-28 US disclosed