SCHEMBL23229178

SCHEMBL23229178

CCCC(CO)c1ccccc1OCc1nn(C(C)C)c2ccc(-c3cccc(CN)c3)cc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFD P00746 7/20 0.37
TPSB2 P20231 5/20 0.35
F11 P03951 4/20 0.35
PLG P00747 2/20 0.35
PLAU P00749 2/20 0.35
KLKB1 P03952 1/20 0.35
F7 P08709 1/20 0.35
FGFR2 P21802 1/20 0.33
FGFR3 P22607 1/20 0.33
PIK3CD O00329 1/20 0.31
ABL1 P00519 1/20 0.31
EGFR P00533 1/20 0.31
HCK P08631 1/20 0.31
SRC P12931 1/20 0.31
KDR P35968 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
MTOR P42345 1/20 0.31
PIK3CG P48736 1/20 0.31
EPHB4 P54760 1/20 0.31

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
SCHEMBL23228977 0.89 CFD (0.37) CFDTPSB2F11PLGPLAU
SCHEMBL29853066 0.87 CFD (0.40) CFDTPSB2F11PLGPLAU
SCHEMBL23219209 0.87 CFD (0.40) CFDTPSB2F11PLGPLAU
SCHEMBL23219193 0.86 CFD (0.43) CFDTPSB2F11PLGPLAU
SCHEMBL29852818 0.86 CFD (0.43) CFDTPSB2F11PLGPLAU
SCHEMBL29853069 0.84 CFD (0.39) CFDTPSB2F11PLGPLAU
SCHEMBL23219028 0.84 CFD (0.39) CFDTPSB2F11PLGPLAU
SCHEMBL29852616 0.83 CFD (0.42) CFDTPSB2F11PLGPLAU
SCHEMBL23219138 0.83 CFD (0.42) CFDTPSB2F11PLGPLAU
SCHEMBL23219231 0.80 PLG (0.46) CFDTPSB2F11PLGPLAU

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