SCHEMBL13613825

SCHEMBL13613825

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
STS P08842 4/20 0.37
P2RY12 Q9H244 4/20 0.37
HRH1 P35367 4/20 0.35
CCR3 P51677 4/20 0.35
LMNA P02545 2/20 0.34
POLB P06746 2/20 0.34
TLR7 Q9NYK1 2/20 0.34
KCNH2 Q12809 2/20 0.34
MGLL Q99685 1/20 0.34
KIT P10721 1/20 0.33
HRH2 P25021 1/20 0.33
ADRA1D P25100 1/20 0.33
HTR2A P28223 1/20 0.33
ADORA2A P29274 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
SCHEMBL13613823 0.94 LMNA (0.41) STSP2RY12HRH1CCR3LMNA
SCHEMBL13613812 0.86 FAAH (0.42) IDO1KDM4EMEN1MAPTKMT2A
SCHEMBL13613810 0.86 TLR7 (0.39) MEN1KMT2ALMNAPOLBTLR7
SCHEMBL13613815 0.84 LCK (0.36) KDM4EMAPTHTTLMNAPOLB
SCHEMBL13613811 0.84 TLR7 (0.39) MEN1KMT2ALMNAPOLBTLR7
SCHEMBL13999873 0.83 NPY5R (0.39) KDM4EMEN1HTTKMT2ALMNA
SCHEMBL13613819 0.82 EPHX2 (0.41) KCNH2
SCHEMBL4338051 0.82 TLR7 (0.40) KDM4ELMNAPOLBTLR7KCNH2
SCHEMBL13613813 0.82 TLR7 (0.38) KDM4ELMNAPOLBTLR7KCNH2
SCHEMBL13999889 0.82 NPY5R (0.37) MEN1HTTKMT2ALMNAPOLB

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