SCHEMBL9601428

SCHEMBL9601428

CC(=O)OCC(Cn1cnc2c(Cl)nc3ccccc3c21)OC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 1/20 0.46
THRB P10828 1/20 0.46
TLR7 Q9NYK1 3/20 0.45
ADRA1A P35348 2/20 0.45
LMNA P02545 1/20 0.45
HRH2 P25021 1/20 0.45
ADRA1D P25100 1/20 0.45
HTR2A P28223 1/20 0.45
ADORA2A P29274 1/20 0.45
NUDT1 P36639 1/20 0.45
HTR2B P41595 1/20 0.45
PDE4D Q08499 1/20 0.45
KCNH2 Q12809 1/20 0.45
KDM4E B2RXH2 2/20 0.43
AR P10275 1/20 0.34
APAF1 O14727 1/20 0.34
TP53 P04637 1/20 0.34
GAA P10253 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
SCHEMBL9603096 0.85 POLB (0.42) POLBMAPTKMT2ATHRBTLR7
SCHEMBL9601932 0.82 TLR7 (0.43) POLBMAPTKMT2ATHRBTLR7
SCHEMBL9602153 0.81 POLB (0.54) POLBMAPTKMT2ATHRBTLR7
SCHEMBL9380199 0.79 USP5 (0.39) POLBMAPTTLR7ADRA1ALMNA
Propionic Acid SCHEMBL6719538 0.77 TLR7 (0.62) POLBTLR7ADRA1ALMNAHRH2
SCHEMBL1774913 0.77 TLR7 (0.72) POLBTLR7ADRA1ALMNAHRH2
SCHEMBL30601166 0.77 TLR7 (0.72) POLBTLR7ADRA1ALMNAHRH2
SCHEMBL29378640 0.77 TLR7 (0.72) POLBTLR7ADRA1ALMNAHRH2
Water SCHEMBL9602104 0.76 TLR7 (0.70) POLBTLR7ADRA1ALMNAHRH2
SCHEMBL6105965 0.75 TLR7 (0.56) POLBTLR7ADRA1ALMNAHRH2

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
EP-0310950-B1 Quinoline intermediates for the synthesis of 1H-imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amimes RIKER LABORATORIES, INC. (US) 1993-01-13 EP disclosed
EP-0145340-B1 1H-Imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amines RIKER LABORATORIES, INC. (US) 1990-01-24 EP disclosed
US-4698348-A 1H-imidazo[4,5-c]quinolines and their use as bronchodilating agents RIKER LABORATORIES, INC. (US) 1987-10-06 US disclosed
EP-0145340-A2 1H-Imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amines RIKER LABORATORIES, INC. (US) 1985-06-19 EP disclosed