SCHEMBL1882183

SCHEMBL1882183

CCCC=Cc1cc2c([nH]c(=O)c(=O)n2Cc2ccccc2)c(Cl)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 4/20 0.42
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
PTGES O14684 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
FGFR1 P11362 1/20 0.37
FGFR3 P22607 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
PNP P00491 1/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 2/20 0.36
HTT P42858 2/20 0.36
MEN1 O00255 1/20 0.36
PSMD14 O00487 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL1882180 1.00 TLR7 (0.42) TLR7PDE4APDE4BPDE4CPDE4D
SCHEMBL1877586 0.89 TLR7 (0.53) TLR7
SCHEMBL1877583 0.89 TLR7 (0.53) TLR7
SCHEMBL1871071 0.79 PTGES (0.45) TLR7PTGESTDP1FGFR1FGFR3
SCHEMBL1874671 0.76 KMT2A (0.51) TLR7KDM4EHPGDMEN1TSHR
SCHEMBL1882626 0.69 TLR7 (0.45) TLR7PTGESADORA3PNPKDM4E
SCHEMBL1870397 0.68 TLR7 (0.70) TLR7PDE4APDE4BPDE4CPDE4D
SCHEMBL1869091 0.67 TLR7 (0.57) TLR7
SCHEMBL1881384 0.67 TLR7 (0.58) TLR7PTGESPNPKDM4EHPGD
SCHEMBL1870034 0.67 TLR7 (0.53) TLR7KDM4EKMT2A

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
WO-2011057148-A1 COMPOUNDS AND COMPOSITIONS AS TLR-7 ACTIVITY MODULATORS IRM LLC (BM) 2011-05-12 WO disclosed