SCHEMBL23219161

SCHEMBL23219161

CCOC(=O)Cc1ccccc1OCc1cnc2ccc(-c3cccc(CN)c3)cn12

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CFD P00746 13/20 0.56
F11 P03951 5/20 0.51
TPSB2 P20231 4/20 0.51
PLAU P00749 2/20 0.51
KLKB1 P03952 2/20 0.51
PLG P00747 1/20 0.51
F7 P08709 1/20 0.51
MET P08581 1/20 0.41
SLC2A2 P11168 1/20 0.40
TBXAS1 P24557 1/20 0.39
TGFBR1 P36897 1/20 0.38

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
SCHEMBL29852662 1.00 CFD (0.56) CFDF11TPSB2PLAUKLKB1
SCHEMBL23218541 0.89 CFD (0.66) CFDF11TPSB2PLAUKLKB1
SCHEMBL29852892 0.89 CFD (0.66) CFDF11TPSB2PLAUKLKB1
SCHEMBL29852984 0.86 CFD (0.56) CFDF11TPSB2PLAUKLKB1
SCHEMBL23218082 0.86 CFD (0.56) CFDF11TPSB2PLAUKLKB1
SCHEMBL28736136 0.82 CFD (0.73) CFDF11TPSB2PLAUKLKB1
SCHEMBL29592574 0.82 CFD (0.73) CFDF11TPSB2PLAUKLKB1
SCHEMBL23219125 0.80 TBXAS1 (0.45) CFDMETSLC2A2TBXAS1
SCHEMBL29852848 0.80 TBXAS1 (0.45) CFDMETSLC2A2TBXAS1
SCHEMBL23218214 0.78 CFD (0.59) CFDF11TPSB2PLAUKLKB1

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-2021072198-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed
WO-2021072198-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed