SCHEMBL29852467

SCHEMBL29852467

CCOC(=O)CCc1ccccc1OCc1cc2cccc(-c3cccc(CN)c3)c2o1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CFD P00746 9/20 0.46
PLG P00747 1/20 0.44
PLAU P00749 1/20 0.44
F11 P03951 1/20 0.44
KLKB1 P03952 1/20 0.44
F7 P08709 1/20 0.44
TPSB2 P20231 1/20 0.44
PTGER1 P34995 2/20 0.41
PTGER4 P35408 2/20 0.41
PTGER3 P43115 2/20 0.41
PTGER2 P43116 2/20 0.41
DHFR P00374 2/20 0.38
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL23218442 1.00 CFD (0.46) CFDPLGPLAUF11KLKB1
SCHEMBL23219109 0.91 CFD (0.55) CFDPLGPLAUF11KLKB1
SCHEMBL29853190 0.91 CFD (0.55) CFDPLGPLAUF11KLKB1
SCHEMBL29852716 0.89 CFD (0.50) CFDPLGPLAUF11KLKB1
SCHEMBL23218093 0.89 CFD (0.50) CFDPLGPLAUF11KLKB1
SCHEMBL23218937 0.89 PTGER4 (0.54) CFDPLGPLAUF11KLKB1
SCHEMBL29592367 0.89 PTGER4 (0.54) CFDPLGPLAUF11KLKB1
SCHEMBL23219130 0.83 CFD (0.54) CFDPLGPLAUF11KLKB1
SCHEMBL23218897 0.83 CFD (0.54) CFDPLGPLAUF11KLKB1
SCHEMBL29853134 0.83 CFD (0.54) CFDPLGPLAUF11KLKB1

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
EP-4041238-A1 ORAL COMPLEMENT FACTOR D INHIBITORS Biocryst Pharmaceuticals, Inc. (US) 2022-08-17 EP disclosed