SCHEMBL13613815

SCHEMBL13613815

CCC(COCCC1CCN(C(=O)NC2CCCCC2)CC1)n1cnc2c(N)nc3ccccc3c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.36
TLR7 Q9NYK1 4/20 0.36
KDM4E B2RXH2 2/20 0.36
LMNA P02545 2/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
POLB P06746 1/20 0.35
HRH2 P25021 1/20 0.35
ADRA1D P25100 1/20 0.35
HTR2A P28223 1/20 0.35
ADORA2A P29274 1/20 0.35
ADRA1A P35348 1/20 0.35
NUDT1 P36639 1/20 0.35
HTR2B P41595 1/20 0.35
PDE4D Q08499 1/20 0.35
KCNH2 Q12809 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SMO Q99835 2/20 0.35

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
SCHEMBL13613810 0.91 TLR7 (0.39) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL13613812 0.89 FAAH (0.42) TLR7KDM4ELMNAPOLBHRH2
SCHEMBL13613819 0.88 EPHX2 (0.41) KCNH2
SCHEMBL13613811 0.87 TLR7 (0.39) TLR7LMNACNR1CNR2POLB
SCHEMBL4338051 0.85 TLR7 (0.40) TLR7KDM4ELMNAPOLBHRH2
SCHEMBL13613823 0.85 LMNA (0.41) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL13613813 0.85 TLR7 (0.38) TLR7KDM4ELMNAPOLBHRH2
SCHEMBL13613820 0.84 LMNA (0.42) TLR7LMNAPOLBMAPT
SCHEMBL13613825 0.84 IDO1 (0.37) TLR7KDM4ELMNAHTTPOLB
SCHEMBL13613817 0.84 CCR3 (0.44) HTTSMN1; SMN2SMOOPRM1ALDH1A1

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