SCHEMBL8722647

SCHEMBL8722647

CC(=O)OCC(C)(C)n1cnc2c[n+]([O-])c3ccccc3c21

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.33
TLR7 Q9NYK1 1/20 0.32
ALDH1A1 P00352 5/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
KDM4E B2RXH2 3/20 0.32
HSD17B10 Q99714 2/20 0.32
ACSS2 Q9NR19 1/20 0.31
NPSR1 Q6W5P4 2/20 0.31
LMNA P02545 2/20 0.31
HTT P42858 1/20 0.31
ABL1 P00519 1/20 0.31
MAPT P10636 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL8722646 0.84 TLR7 (0.35) RAB9ATLR7
SCHEMBL8721699 0.80 HPGD (0.34) RAB9ATLR7MEN1KMT2AKDM4E
SCHEMBL10731238 0.80 TLR7 (0.34) RAB9ATLR7ALDH1A1MEN1KMT2A
SCHEMBL9381029 0.76 USP5 (0.36) RAB9AALDH1A1MEN1KMT2AKDM4E
SCHEMBL8721705 0.76 ALDH1A1 (0.33) RAB9ATLR7ALDH1A1MEN1KMT2A
SCHEMBL8722632 0.75 TLR7 (0.40) RAB9ATLR7ALDH1A1MEN1KMT2A
SCHEMBL9602904 0.73 POLB (0.48) RAB9ATLR7ALDH1A1KMT2AKDM4E
SCHEMBL10733260 0.73 DPP4 (0.36) TLR7ALDH1A1MEN1KMT2AKDM4E
SCHEMBL10739313 0.72 TLR7 (0.49) TLR7MEN1KMT2ANPSR1LMNA
SCHEMBL8722638 0.72 TLR7 (0.39) RAB9ATLR7ALDH1A1MEN1KMT2A

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
US-5756747-A 1H-imidazo 4,5-c!quinolin-4-amines RIKER LABORATORIES, INC. (US) 1998-05-26 US disclosed
EP-0385630-B1 1H-imidazo(4,5-c)Quinolin-4-amines as antivirals RIKER LABORATORIES INC (US) 1996-11-27 EP disclosed
EP-0389302-B1 Olefinic 1H-imidazo [4,5-c]quinolin-4-amines RIKER LABORATORIES INC (US) 1994-08-31 EP disclosed
US-5037986-A Olefinic 1H-imidazo[4,5-c]quinolin-4-amines MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-08-06 US disclosed
EP-0389302-A1 Olefinic 1H-imidazo [4,5-c]quinolin-4-amines RIKER LABORATORIES, INC. (US) 1990-09-26 EP disclosed
EP-0385630-A2 1H-imidazo(4,5-c)Quinolin-4-amines as antivirals RIKER LABORATORIES, INC. (US) 1990-09-05 EP disclosed