SCHEMBL28526247

SCHEMBL28526247

Nc1nc2c(nc(Br)n2C2OC(CO)CC2O)c(=O)[nH]1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PNP P00491 2/20 0.52
MAPT P10636 2/20 0.51
BLM P54132 1/20 0.51
PMP22 Q01453 1/20 0.51
TSHR P16473 1/20 0.51
NFKB1 P19838 1/20 0.51
ALDH1A1 P00352 1/20 0.50
TLR7 Q9NYK1 8/20 0.48
CYP3A4 P08684 1/20 0.44
PDE7A Q13946 2/20 0.43
PDE7B Q9NP56 2/20 0.43

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
SCHEMBL23202125 1.00 PNP (0.52) PNPMAPTBLMPMP22TSHR
SCHEMBL28542518 0.83 ALDH1A1 (0.45) PNPMAPTBLMPMP22TSHR
SCHEMBL20310514 0.80 PNP (0.54) PNPMAPTBLMPMP22TSHR
SCHEMBL657360 0.80 PNP (0.54) PNPMAPTBLMPMP22TSHR
SCHEMBL10109648 0.80 PNP (0.54) PNPMAPTBLMPMP22TSHR
SCHEMBL13351290 0.80 PNP (0.54) PNPMAPTBLMPMP22TSHR
SCHEMBL657361 0.80 PNP (0.54) PNPMAPTBLMPMP22TSHR
SCHEMBL13318964 0.80 PNP (0.54) PNPMAPTBLMPMP22TSHR
SCHEMBL14543297 0.80 PNP (0.54) PNPMAPTBLMPMP22TSHR
SCHEMBL10117789 0.80 PNP (0.79) PNPMAPTBLMPMP22TSHR

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
CN-112533607-A TLR7 agonists 普利缪尼治疗学股份有限公司 2021-03-19 CN disclosed