SCHEMBL8121983

SCHEMBL8121983

CC(=O)OCCOCn1cnc2c(N)nc3ccccc3c21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 14/20 0.56
NUDT1 P36639 2/20 0.56
LMNA P02545 1/20 0.56
POLB P06746 1/20 0.56
HRH2 P25021 1/20 0.56
ADRA1D P25100 1/20 0.56
HTR2A P28223 1/20 0.56
ADORA2A P29274 1/20 0.56
ADRA1A P35348 1/20 0.56
HTR2B P41595 1/20 0.56
PDE4D Q08499 1/20 0.56
KCNH2 Q12809 1/20 0.56
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
TSHR P16473 1/20 0.45
TLR8 Q9NR97 5/20 0.39
MAPK1 P28482 1/20 0.39
HBB P68871 1/20 0.39
KDM4E B2RXH2 1/20 0.38
RECQL P46063 1/20 0.38

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
SCHEMBL8123283 0.84 TLR7 (0.60) TLR7NUDT1LMNAPOLBHRH2
SCHEMBL3518335 0.82 TLR7 (0.65) TLR7NUDT1LMNAPOLBHRH2
Bromide SCHEMBL5805007 0.81 TLR7 (0.64) TLR7NUDT1LMNAPOLBHRH2
SCHEMBL6105045 0.78 TLR7 (0.60) TLR7NUDT1LMNAPOLBHRH2
SCHEMBL27365707 0.75 TLR7 (0.69) TLR7NUDT1LMNAPOLBHRH2
SCHEMBL11249941 0.75 MEN1 (0.57) HTR2AADRA1AMEN1KMT2ATSHR
SCHEMBL22043512 0.75 TLR7 (0.62) TLR7NUDT1LMNAPOLBHRH2
SCHEMBL30773474 0.75 TLR7 (0.73) TLR7NUDT1LMNAPOLBHRH2
SCHEMBL22803659 0.75 TLR7 (0.73) TLR7NUDT1LMNAPOLBHRH2
SCHEMBL22803781 0.75 TLR7 (0.65) TLR7NUDT1LMNAPOLBHRH2

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-0603251-B1 1-SUBSTITUTED 1H-IMIDAZO(4,5-C)QUINOLIN-4-AMINES; INTERMEDIATE AND PHARMACEUTICAL COMPOSITIONS MINNESOTA MINING & MFG (US) 2000-10-18 EP disclosed
US-5525612-A ANTIVIRAL PHARMACEUTICAL COMPOSITION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-06-11 US disclosed
US-5346905-A Induce interferon biosynthesis; viricides, effective against herpes virus; immunomodulators MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-09-13 US disclosed
EP-0603251-A1 1-SUBSTITUTED 1H-IMIDAZO(4,5-C)QUINOLIN-4-AMINES; INTERMEDIATE AND PHARMACEUTICAL COMPOSITIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-06-29 EP disclosed
US-5268376-A Containing alkoxy substitution MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-12-07 US disclosed
WO-1993005042-A1 1-SUBSTITUTED 1H-IMIDAZO(4,5-C)QUINOLIN-4-AMINES; INTERMEDIATE AND PHARMACEUTICAL COMPOSITIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-03-18 WO disclosed