SCHEMBL1871071

SCHEMBL1871071

O=c1[nH]c2c(Cl)nc(Br)cc2n(Cc2ccccc2)c1=O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.45
TLR7 Q9NYK1 4/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 2/20 0.44
HTT P42858 2/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
CFTR P13569 2/20 0.42
TDP1 Q9NUW8 1/20 0.40
FGFR1 P11362 1/20 0.40
FGFR3 P22607 1/20 0.40
PNP P00491 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ADORA3 P0DMS8 1/20 0.39
PSMD14 O00487 1/20 0.39
TSHR P16473 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
SCHEMBL1882626 0.89 TLR7 (0.45) PTGESTLR7KDM4EHPGDHTT
SCHEMBL1881384 0.86 TLR7 (0.58) PTGESTLR7KDM4EHPGDHTT
SCHEMBL1882183 0.79 TLR7 (0.42) PTGESTLR7KDM4EHPGDHTT
SCHEMBL1882180 0.79 TLR7 (0.42) PTGESTLR7KDM4EHPGDHTT
SCHEMBL1874671 0.77 KMT2A (0.51) TLR7KDM4EHPGDALDH1A1MEN1
SCHEMBL2573488 0.74 TLR7 (0.73) TLR7HPGDALDH1A1
SCHEMBL1876573 0.71 TLR7 (0.81) TLR7
SCHEMBL9395727 0.71 KDM4E (0.48) KDM4EHPGDHTTALDH1A1GAA
SCHEMBL1877586 0.69 TLR7 (0.53) TLR7
SCHEMBL1877583 0.69 TLR7 (0.53) 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 2 patents. 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
WO-2011057148-A1 COMPOUNDS AND COMPOSITIONS AS TLR-7 ACTIVITY MODULATORS IRM LLC (BM) 2011-05-12 WO disclosed