SCHEMBL5506468

SCHEMBL5506468

CCCn1cc2c(n1)c(Cl)nc1ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 2/20 0.60
TLR8 Q9NR97 1/20 0.60
SLC2A1 P11166 4/20 0.43
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
MAPT P10636 2/20 0.40
TSHR P16473 2/20 0.40
MAPK1 P28482 2/20 0.40
CASP1 P29466 2/20 0.40
CASP7 P55210 2/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
ALOX15 P16050 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
MAT2A P31153 1/20 0.39

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
SCHEMBL29787346 0.92 TLR8 (0.72) TLR7TLR8SLC2A1KDM4EALDH1A1
SCHEMBL22806917 0.92 TLR8 (0.72) TLR7TLR8SLC2A1KDM4EALDH1A1
SCHEMBL5507108 0.83 TLR7 (0.57) TLR7TLR8SLC2A1KDM4EALDH1A1
SCHEMBL1232530 0.83 TLR7 (0.85) TLR7TLR8ADORA3ADORA2AADORA1
SCHEMBL5507105 0.81 TLR8 (0.41) TLR7TLR8SLC2A1MAPTTSHR
SCHEMBL17083434 0.80 MAOA (0.46) TLR7TLR8KDM4ETDP1MAOA
SCHEMBL14323257 0.77 ADORA3 (0.48) TLR7TLR8KDM4EALDH1A1HPGD
SCHEMBL1233701 0.75 TLR8 (1.00) TLR7TLR8ADORA3ADORA2AADORA1
SCHEMBL29720427 0.75 TLR8 (1.00) TLR7TLR8ADORA3ADORA2AADORA1
SCHEMBL22445125 0.74 TLR8 (0.50) TLR7TLR8KDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1869043-A2 PYRAZOLOPYRIDINE-1,4-DIAMINES AND ANALOGS THEREOF Coley Pharmaceutical Group, Inc. (US) 2007-12-26 EP disclosed
WO-2006107853-A2 PYRAZOLOPYRIDINE-1,4-DIAMINES AND ANALOGS THEREOF COLEY PHARMACEUTICAL GROUP, INC. (US) 2006-10-12 WO disclosed