SCHEMBL17689256

SCHEMBL17689256

COCCOc1cc2c(nc(O)n2Cc2ccc(CP(C)(=O)O)cc2)c(N)n1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 17/20 0.44
NUDT1 P36639 1/20 0.35
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GLA P06280 2/20 0.33
GAA P10253 2/20 0.33
HPGD P15428 2/20 0.33
CASP1 P29466 2/20 0.33
CASP7 P55210 2/20 0.33
HSD17B10 Q99714 2/20 0.33
USP2 O75604 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33

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 0.93 TLR7 (0.38) TLR7NUDT1KDM4EALDH1A1GLA
SCHEMBL174740 0.76 TLR7 (0.52) TLR7NUDT1
SCHEMBL563781 0.75 TLR7 (0.54) TLR7
SCHEMBL15436859 0.75 TLR7 (0.36) TLR7KDM4EALDH1A1GLAGAA
SCHEMBL15443134 0.75 TLR7 (0.45) TLR7
SCHEMBL3921296 0.74 TLR7 (0.68) TLR7NUDT1
SCHEMBL161256 0.74 TLR7 (0.57) TLR7NUDT1
SCHEMBL23421426 0.72 TLR7 (0.43) TLR7
SCHEMBL23420171 0.71 TLR7 (0.41) TLR7
SCHEMBL3933268 0.70 TLR7 (0.57) TLR7NUDT1

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
US-9375471-B2 Adjuvanted formulations of booster vaccines GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2016-06-28 US disclosed
US-9315530-B2 Adsorption of immunopotentiators to insoluble metal salts NOVARTIS AG (CH) 2016-04-19 US disclosed