SCHEMBL9602472

SCHEMBL9602472

CC(=O)OCC(Cn1c(C)nc2c[n+]([O-])c3ccccc3c21)OC(C)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.40
MAPT P10636 4/20 0.35
AGER Q15109 1/20 0.35
POLB P06746 3/20 0.35
THRB P10828 1/20 0.35
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 1/20 0.33
TSHR P16473 2/20 0.33
RAB9A P51151 1/20 0.33
GFER P55789 1/20 0.33
APAF1 O14727 1/20 0.33
ALDH1A1 P00352 3/20 0.32
HPGD P15428 2/20 0.32
HSD17B10 Q99714 1/20 0.32
SAE1 Q9UBE0 1/20 0.32
UBA2 Q9UBT2 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL6107744 0.82 ALDH1A1 (0.39) MAPTKMT2AKDM4EMEN1TSHR
SCHEMBL9602904 0.81 POLB (0.48) GAAMAPTPOLBTHRBKMT2A
SCHEMBL9602557 0.81 MAPT (0.41) GAAMAPTAGERPOLBTHRB
SCHEMBL10734696 0.79 ALDH1A1 (0.40) MAPTAGERKMT2AKDM4EMEN1
SCHEMBL9601932 0.75 TLR7 (0.43) GAAMAPTPOLBTHRBKMT2A
SCHEMBL10728090 0.75 TSHR (0.41) GAAMAPTAGERPOLBKMT2A
SCHEMBL10739285 0.74 TLR7 (0.50) MAPTKMT2AMEN1TSHRRAB9A
SCHEMBL10730689 0.73 MEN1 (0.55) MAPTKMT2AKDM4EMEN1TSHR
Water SCHEMBL9603229 0.73 TLR7 (0.49) MAPTKMT2AMEN1TSHRRAB9A
SCHEMBL10586993 0.71 GALR3 (0.52) MAPTKMT2AKDM4EMEN1RAB9A

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 6 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
EP-0310950-A1 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) 1989-04-12 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
US-4689338-A 1H-Imidazo[4,5-c]quinolin-4-amines and antiviral use RIKER LABORATORIES, INC. (US) 1987-08-25 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