SCHEMBL23218836

SCHEMBL23218836

CCOC(=O)Cc1ccccc1OCc1coc2c(-c3ccc(CN4CCN(C)CC4)cc3)cc(-c3cccc(CN)c3)cc12

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CFD P00746 10/20 0.45
F11 P03951 3/20 0.41
TPSB2 P20231 2/20 0.41
KLKB1 P03952 2/20 0.41
PLG P00747 1/20 0.41
PLAU P00749 1/20 0.41
F7 P08709 1/20 0.41
CD274 Q9NZQ7 5/20 0.38
PDCD1 Q15116 1/20 0.38
SUCNR1 Q9BXA5 1/20 0.37
TNIK Q9UKE5 1/20 0.34
MELK Q14680 1/20 0.34

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
SCHEMBL29853135 1.00 CFD (0.45) CFDF11TPSB2KLKB1PLG
SCHEMBL23218519 0.92 CFD (0.51) CFDF11TPSB2KLKB1PLG
SCHEMBL29852973 0.92 CFD (0.51) CFDF11TPSB2KLKB1PLG
SCHEMBL29852754 0.92 CFD (0.48) CFDF11TPSB2KLKB1PLG
SCHEMBL23218099 0.92 CFD (0.48) CFDF11TPSB2KLKB1PLG
SCHEMBL23219114 0.89 CFD (0.52) CFDF11TPSB2KLKB1PLG
SCHEMBL29853180 0.89 CFD (0.52) CFDF11TPSB2KLKB1PLG
SCHEMBL23218079 0.88 CFD (0.52) CFDF11TPSB2KLKB1PLG
SCHEMBL29852554 0.88 CFD (0.52) CFDF11TPSB2KLKB1PLG
SCHEMBL23218778 0.87 CD274 (0.40) CFDCD274PDCD1SUCNR1

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