SCHEMBL13613823

SCHEMBL13613823

CCC(COCCC1CCN(C(=O)NS(=O)(=O)c2ccc(C)cc2)CC1)n1cnc2c(N)nc3ccccc3c21

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
POLB P06746 2/20 0.41
P2RY12 Q9H244 3/20 0.36
KCNA1 Q09470 3/20 0.35
KCNAB1 Q14722 3/20 0.35
TLR7 Q9NYK1 2/20 0.34
HRH1 P35367 6/20 0.34
CCR3 P51677 6/20 0.34
KCNH2 Q12809 2/20 0.34
HRH2 P25021 1/20 0.34
ADRA1D P25100 1/20 0.34
HTR2A P28223 1/20 0.34
ADORA2A P29274 1/20 0.34
ADRA1A P35348 1/20 0.34
NUDT1 P36639 1/20 0.34
HTR2B P41595 1/20 0.34
PDE4D Q08499 1/20 0.34
STS P08842 1/20 0.33
ADAM17 P78536 2/20 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
SCHEMBL13613825 0.94 IDO1 (0.37) LMNAPOLBP2RY12TLR7HRH1
SCHEMBL13613810 0.87 TLR7 (0.39) LMNAPOLBTLR7KCNH2HRH2
SCHEMBL13613812 0.87 FAAH (0.42) LMNAPOLBTLR7KCNH2HRH2
SCHEMBL13613815 0.85 LCK (0.36) LMNAPOLBTLR7KCNH2HRH2
SCHEMBL13999873 0.83 NPY5R (0.39) LMNAPOLBTLR7KCNH2HRH2
SCHEMBL13613819 0.83 EPHX2 (0.41) KCNH2
SCHEMBL4338051 0.83 TLR7 (0.40) LMNAPOLBTLR7KCNH2HRH2
SCHEMBL13999889 0.82 NPY5R (0.37) LMNAPOLBTLR7KCNH2HRH2
SCHEMBL13613813 0.82 TLR7 (0.38) LMNAPOLBTLR7KCNH2HRH2
SCHEMBL13613820 0.82 LMNA (0.42) LMNAPOLBTLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612083-B2 Urea substituted imidazoquinoline ethers COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-11-03 US disclosed
US-7612083-B2 Urea substituted imidazoquinoline ethers COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-11-03 US disclosed
US-7214675-B2 Urea substituted imidazoquinoline ethers 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-08 US disclosed
US-7214675-B2 Urea substituted imidazoquinoline ethers 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-08 US disclosed