SCHEMBL3884752

SCHEMBL3884752

CCCOC(=O)Nc1nc2ccccc2c2c1nc(CC)n2CCCCNS(C)(=O)=O

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 15/20 0.65
TDP1 Q9NUW8 2/20 0.39
TLR8 Q9NR97 1/20 0.39
TOP2A P11388 1/20 0.37
PPARG P37231 1/20 0.37
NPC1 O15118 1/20 0.37
TP53 P04637 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL3884928 0.96 TLR7 (0.64) TLR7TDP1TLR8PPARGNPC1
SCHEMBL3888482 0.93 TLR7 (0.67) TLR7TDP1TLR8
SCHEMBL3884418 0.88 TLR7 (0.72) TLR7TDP1TLR8PPARG
SCHEMBL4523563 0.86 TLR7 (0.69) TLR7TDP1TLR8TP53RAB9A
SCHEMBL3892251 0.85 TLR7 (0.68) TLR7TDP1TLR8
SCHEMBL4526411 0.85 TLR7 (0.68) TLR7TDP1TLR8PPARG
SCHEMBL9070687 0.85 TLR7 (0.68) TLR7TDP1TLR8PPARG
SCHEMBL20284105 0.82 TLR7 (0.73) TLR7TDP1TLR8
SCHEMBL12409397 0.81 TLR7 (0.81) TLR7TDP1TLR8
SCHEMBL14567933 0.80 TLR7 (0.49) TLR7TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188111-B2 Amide and carbamate derivatives of alkyl substituted N-[4-(4-amino-1H-imidazo[4,5-c]quinolin-1-yl)butyI]methanesulfonamides and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-05-29 US disclosed
US-8188111-B2 Amide and carbamate derivatives of alkyl substituted N-[4-(4-amino-1H-imidazo[4,5-c]quinolin-1-yl)butyI]methanesulfonamides and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-05-29 US disclosed
US-8188111-B2 Amide and carbamate derivatives of alkyl substituted N-[4-(4-amino-1H-imidazo[4,5-c]quinolin-1-yl)butyI]methanesulfonamides and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-05-29 US disclosed
US-20090176821-A1 Amide and Carbamate Derivatives of Alkyl Substituted N-[4-(4-Amino-1H-Imidazo[4,5-C] Quinolin-1-YL)Butyl]Methanesulfonamides and Methods COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-07-09 US disclosed
US-20090176821-A1 Amide and Carbamate Derivatives of Alkyl Substituted N-[4-(4-Amino-1H-Imidazo[4,5-C] Quinolin-1-YL)Butyl]Methanesulfonamides and Methods COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-07-09 US disclosed
US-20090176821-A1 Amide and Carbamate Derivatives of Alkyl Substituted N-[4-(4-Amino-1H-Imidazo[4,5-C] Quinolin-1-YL)Butyl]Methanesulfonamides and Methods COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-07-09 US disclosed
EP-1924582-A4 AMIDE AND CARBAMATE DERIVATIVES OF ALKYL SUBSTITUTED N-[4-(4-AMINO-1H-IMIDAZO[4,5-C]QUINOLIN-1-YL)BUTYL]METHANESULFONAMIDES AND METHODS COLEY PHARM GROUP INC (US) 2009-04-15 EP disclosed
EP-1924582-A2 AMIDE AND CARBAMATE DERIVATIVES OF ALKYL SUBSTITUTED N-[4-(4-AMINO-1H-IMIDAZO[4,5-C]QUINOLIN-1-YL)BUTYL]METHANESULFONAMIDES AND METHODS Coley Pharmaceutical Group, Inc. (US) 2008-05-28 EP disclosed
WO-2007030777-A2 AMIDE AND CARBAMATE DERIVATIVES OF ALKYL SUBSTITUTED N-[4-(4-AMINO-1H-IMIDAZO[4,5-C]QUINOLIN-1-YL)BUTYL]METHANESULFONAMIDES AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-03-15 WO disclosed
WO-2007030777-A2 AMIDE AND CARBAMATE DERIVATIVES OF ALKYL SUBSTITUTED N-[4-(4-AMINO-1H-IMIDAZO[4,5-C]QUINOLIN-1-YL)BUTYL]METHANESULFONAMIDES AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-03-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090176821-A1 Amide and Carbamate Derivatives of Alkyl Substituted N-[4-(4-Amino-1H-Imidazo[4,5-C] Quinolin-1-YL)Butyl]Methanesulfonamides and Methods IFNG, CCL11, IL4 TLR7 273/4885TDP1 3256/4885TLR8 223/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.