SCHEMBL15436859

SCHEMBL15436859

COCCC(C)c1cc2c(nc(O)n2Cc2ccc(CP(=O)(O)O)cc2)c(N)n1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 14/20 0.36
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
GLA P06280 2/20 0.32
GAA P10253 2/20 0.32
HPGD P15428 2/20 0.32
CASP1 P29466 2/20 0.32
CASP7 P55210 2/20 0.32
HSD17B10 Q99714 2/20 0.32
USP2 O75604 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TLR8 Q9NR97 2/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
MAPT P10636 1/20 0.30
TSHR P16473 1/20 0.30
FEN1 P39748 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
SCHEMBL10310957 0.82 TLR7 (0.38) TLR7KDM4EALDH1A1GLAGAA
SCHEMBL15443134 0.80 TLR7 (0.45) TLR7
SCHEMBL17689256 0.75 TLR7 (0.44) TLR7KDM4EALDH1A1GLAGAA
SCHEMBL161256 0.73 TLR7 (0.57) TLR7
SCHEMBL3922181 0.66 TLR7 (0.59) TLR7
SCHEMBL174740 0.65 TLR7 (0.52) TLR7
SCHEMBL18138155 0.64 ADORA1 (0.48) TLR7KDM4EALDH1A1GLAGAA
SCHEMBL562801 0.63 TLR7 (0.60) TLR7
SCHEMBL3933268 0.63 TLR7 (0.57) TLR7
SCHEMBL3920634 0.62 TLR7 (0.55) TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2480253-B1 ADSORPTION OF IMMUNOPOTENTIATORS TO INSOLUBLE METAL SALTS NOVARTIS AG (CH) 2014-01-22 EP disclosed