SCHEMBL23218685

SCHEMBL23218685

Cn1nc(COc2ccccc2CC(=O)O)c2cc(-c3cccc(CN)c3)ccc21

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CFD P00746 19/20 0.65
F11 P03951 10/20 0.65
TPSB2 P20231 9/20 0.65
PLAU P00749 2/20 0.65
KLKB1 P03952 2/20 0.65
PLG P00747 1/20 0.65
F7 P08709 1/20 0.65

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
SCHEMBL29593209 1.00 CFD (0.65) CFDF11TPSB2PLAUKLKB1
SCHEMBL23218665 0.90 CFD (0.52) CFDF11TPSB2PLAUKLKB1
SCHEMBL29591347 0.90 CFD (0.52) CFDF11TPSB2PLAUKLKB1
SCHEMBL29852946 0.90 CFD (0.64) CFDF11TPSB2PLAUKLKB1
SCHEMBL23218820 0.90 CFD (0.64) CFDF11TPSB2PLAUKLKB1
SCHEMBL23218404 0.89 CFD (0.65) CFDF11TPSB2PLAUKLKB1
SCHEMBL29592669 0.89 CFD (0.65) CFDF11TPSB2PLAUKLKB1
SCHEMBL23218852 0.89 CFD (0.50) CFDF11TPSB2PLAUKLKB1
SCHEMBL29591491 0.89 CFD (0.50) CFDF11TPSB2PLAUKLKB1
SCHEMBL23219211 0.89 CFD (0.62) 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 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