SCHEMBL13613817

SCHEMBL13613817

CCC(COCCC1CCN(C(=O)Nc2cccc(OC)c2)CC1)n1cnc2c(N)nc3ccccc3c21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 4/20 0.44
ALOX15 P16050 1/20 0.43
FAAH O00519 1/20 0.42
KIT P10721 1/20 0.40
SMO Q99835 1/20 0.40
CHEK1 O14757 1/20 0.40
AURKA O14965 1/20 0.40
PRKD3 O94806 1/20 0.40
PAK4 O96013 1/20 0.40
NTRK1 P04629 1/20 0.40
FYN P06241 1/20 0.40
RET P07949 1/20 0.40
MET P08581 1/20 0.40
PDGFRB P09619 1/20 0.40
PIM1 P11309 1/20 0.40
PDGFRA P16234 1/20 0.40
PRKACA P17612 1/20 0.40
MAP2K2 P36507 1/20 0.40
FLT3 P36888 1/20 0.40
CDK8 P49336 1/20 0.40

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
SCHEMBL13613812 0.93 FAAH (0.42) FAAHGSK3BALDH1A1SMN1; SMN2
SCHEMBL13613820 0.91 LMNA (0.42) FAAHNPC1RAB9A
SCHEMBL13613824 0.90 TAS1R3 (0.40) NPC1RAB9ATP53ALDH1A1SMN1; SMN2
SCHEMBL13613822 0.90 CCR2 (0.40) FAAHNPC1RAB9ATP53ALDH1A1
SCHEMBL13613816 0.90 CYP2D6 (0.37) CCR3FAAHGRIN2BALDH1A1
SCHEMBL13613810 0.85 TLR7 (0.39)
SCHEMBL13613827 0.84 KMT2A (0.38) PDGFRB
SCHEMBL13613811 0.84 TLR7 (0.39)
SCHEMBL13613819 0.82 EPHX2 (0.41)
SCHEMBL4338051 0.82 TLR7 (0.40)

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