SCHEMBL23219243

SCHEMBL23219243

CCOC(=O)Cc1ccccc1OCc1nn(C(C)C)c2ccc(-c3cccc(CN)c3)cc12

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CFD P00746 15/20 0.62
TPSB2 P20231 7/20 0.48
F11 P03951 7/20 0.48
PLAU P00749 2/20 0.48
KLKB1 P03952 2/20 0.48
PLG P00747 1/20 0.48
F7 P08709 1/20 0.48
ICMT O60725 2/20 0.38
TBXAS1 P24557 1/20 0.38
DPP4 P27487 1/20 0.36

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
SCHEMBL29853182 1.00 CFD (0.62) CFDTPSB2F11PLAUKLKB1
SCHEMBL23219207 0.95 CFD (0.55) CFDTPSB2F11PLAUKLKB1
SCHEMBL29852913 0.95 CFD (0.55) CFDTPSB2F11PLAUKLKB1
SCHEMBL29852792 0.92 CFD (0.52) CFDTPSB2F11PLAUKLKB1
SCHEMBL23218809 0.92 CFD (0.52) CFDTPSB2F11PLAUKLKB1
SCHEMBL23218956 0.92 CFD (0.52) CFDTPSB2F11PLAUKLKB1
SCHEMBL29852665 0.92 CFD (0.52) CFDTPSB2F11PLAUKLKB1
SCHEMBL23218752 0.90 CFD (0.49) CFDTPSB2F11PLAUKLKB1
SCHEMBL29852706 0.90 CFD (0.49) CFDTPSB2F11PLAUKLKB1
SCHEMBL23219211 0.90 CFD (0.62) CFDTPSB2F11PLAUKLKB1

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