SCHEMBL13613835

SCHEMBL13613835

COc1ccc(NC(=O)NCCOCCn2cnc3c(N)nc4ccccc4c32)c(OC)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.46
MEN1 O00255 3/20 0.46
LMNA P02545 3/20 0.44
TP53 P04637 3/20 0.43
TLR7 Q9NYK1 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 2/20 0.42
PPARG P37231 1/20 0.42
NCOA2 Q15596 1/20 0.42
POLB P06746 1/20 0.42
HRH2 P25021 1/20 0.42
ADRA1D P25100 1/20 0.42
HTR2A P28223 1/20 0.42
ADORA2A P29274 1/20 0.42
ADRA1A P35348 1/20 0.42
NUDT1 P36639 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
SCHEMBL13613832 0.88 CASR (0.45) KMT2ALMNATP53TLR7ALDH1A1
SCHEMBL13613829 0.83 TLR7 (0.48) LMNATLR7CYP3A4ALDH1A1MAPT
SCHEMBL13613805 0.82 TLR7 (0.55) KMT2AMEN1TLR7
SCHEMBL13613828 0.81 TLR7 (0.55) KMT2AMEN1LMNATLR7MAPT
SCHEMBL14592712 0.78 TLR7 (0.47) KMT2ALMNATP53TLR7ALDH1A1
SCHEMBL13613831 0.78 CCR3 (0.43) KMT2AMEN1LMNATLR7ALDH1A1
SCHEMBL13613830 0.78 TLR7 (0.44) KMT2AMEN1LMNATP53TLR7
SCHEMBL13613838 0.77 TLR7 (0.46) LMNATLR7PPARGPOLBHRH2
SCHEMBL4335984 0.77 TLR7 (0.54) LMNATLR7POLBHRH2ADRA1D
SCHEMBL6891296 0.77 TP53 (0.50) KMT2AMEN1TP53CYP1A2CYP3A4

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