SCHEMBL23219202

SCHEMBL23219202

CC(C)n1cc(-c2cc(-c3cccc(CN)c3)cc3c(COc4ccccc4CC(=O)O)coc23)cn1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CFD P00746 19/20 0.52
TPSB2 P20231 9/20 0.52
F11 P03951 8/20 0.52
PLAU P00749 2/20 0.52
PLG P00747 1/20 0.52
KLKB1 P03952 1/20 0.52
F7 P08709 1/20 0.52

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
SCHEMBL29852834 1.00 CFD (0.52) CFDTPSB2F11PLAUPLG
SCHEMBL23218865 0.92 CFD (0.49) CFDTPSB2F11PLAUPLG
SCHEMBL29853012 0.92 CFD (0.49) CFDTPSB2F11PLAUPLG
SCHEMBL29852440 0.90 CFD (0.54) CFDTPSB2F11PLAUPLG
SCHEMBL23219135 0.90 CFD (0.54) CFDTPSB2F11PLAUPLG
SCHEMBL23218960 0.90 CFD (0.51) CFDTPSB2F11PLAUPLG
SCHEMBL29852872 0.90 CFD (0.51) CFDTPSB2F11PLAUPLG
SCHEMBL29853123 0.89 CFD (0.53) CFDTPSB2F11PLAUPLG
SCHEMBL23218550 0.89 CFD (0.53) CFDTPSB2F11PLAUPLG
SCHEMBL23218900 0.87 CFD (0.66) CFDTPSB2F11PLAUPLG

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114502168-A Oral complement factor D inhibitors 拜奥克里斯特制药公司 2022-05-13 CN disclosed
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