SCHEMBL23217703

SCHEMBL23217703

CCOC(=O)Cc1ccccc1OCCc1cc(-c2cccc(CN)c2)c2occc2c1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CFD P00746 16/20 0.57
PLAU P00749 2/20 0.44
PLG P00747 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
TBXAS1 P24557 1/20 0.39
DHFR P00374 2/20 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
SCHEMBL21437609 0.91 CFD (0.69) CFDPLAUPLGF11KLKB1
SCHEMBL31090095 0.91 CFD (0.69) CFDPLAUPLGF11KLKB1
SCHEMBL23217218 0.89 CFD (0.72) CFDPLAUPLGF11KLKB1
SCHEMBL21438544 0.86 CFD (0.62) CFDPLAUPLGF11KLKB1
SCHEMBL21438250 0.85 CFD (0.78) CFDPLAUPLGF11KLKB1
SCHEMBL23217635 0.85 CFD (0.60) CFDPLAUPLGF11KLKB1
SCHEMBL21437517 0.84 CFD (0.65) CFDPLAUPLGF11KLKB1
SCHEMBL23218035 0.84 CFD (0.52) CFDPLAUPLGF11KLKB1
SCHEMBL29853046 0.84 CFD (0.52) CFDPLAUPLGF11KLKB1
SCHEMBL23217614 0.84 TBXAS1 (0.44) CFDTBXAS1DHFR

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
EP-4041717-A1 ORAL COMPLEMENT FACTOR D INHIBITORS Biocryst Pharmaceuticals, Inc. (US) 2022-08-17 EP disclosed
CN-114555570-A Oral complement factor D inhibitors 拜奥克里斯特制药公司 2022-05-27 CN disclosed
WO-2021072156-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed