SCHEMBL23217511

SCHEMBL23217511

CCOC(=O)Cc1ccccc1OCc1cc(Br)c2occc2c1OCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DUSP3 P51452 1/20 0.42
PTPN5 P54829 1/20 0.42
PTPN11 Q06124 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.42
PTGDR2 Q9Y5Y4 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CFD P00746 6/20 0.38
TBXAS1 P24557 1/20 0.38
SLC26A3 P40879 1/20 0.36
THRA P10827 1/20 0.36
THRB P10828 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
SCHEMBL30010173 0.90 CFD (0.39) DUSP3PTPN5PTPN11CTDSP1MEN1
SCHEMBL23217835 0.90 CFD (0.39) DUSP3PTPN5PTPN11CTDSP1MEN1
SCHEMBL23217842 0.90 KCNA3 (0.41) DUSP3PTPN5PTPN11CTDSP1MEN1
SCHEMBL30010388 0.90 KCNA3 (0.41) DUSP3PTPN5PTPN11CTDSP1MEN1
SCHEMBL23241696 0.90 L3MBTL1 (0.37) DUSP3PTPN5PTPN11CTDSP1L3MBTL1
SCHEMBL30009863 0.90 L3MBTL1 (0.37) DUSP3PTPN5PTPN11CTDSP1L3MBTL1
SCHEMBL30010445 0.89 DUSP3 (0.37) DUSP3PTPN5PTPN11CTDSP1L3MBTL1
SCHEMBL30010464 0.87 CFD (0.38) DUSP3PTPN5PTPN11CTDSP1MEN1
SCHEMBL23217640 0.87 CFD (0.38) DUSP3PTPN5PTPN11CTDSP1MEN1
SCHEMBL21437621 0.87 DUSP3 (0.43) DUSP3PTPN5PTPN11CTDSP1MEN1

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-2021072156-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed