SCHEMBL23218165

SCHEMBL23218165

COc1ccc(CC(=O)O)c(OCc2c(C)oc3ccc(-c4cccc(CCN)c4)cc23)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CFD P00746 7/20 0.43
F11 P03951 5/20 0.43
TPSB2 P20231 5/20 0.43
KLKB1 P03952 2/20 0.43
PLG P00747 1/20 0.43
PLAU P00749 1/20 0.43
F7 P08709 1/20 0.43
ANO1 Q5XXA6 3/20 0.42
PTGER4 P35408 1/20 0.42
FFAR1 O14842 5/20 0.42
PPARD Q03181 3/20 0.41
MAOB P27338 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38

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
SCHEMBL23218068 0.93 CFD (0.51) CFDF11TPSB2KLKB1PLG
SCHEMBL29591349 0.93 CFD (0.51) CFDF11TPSB2KLKB1PLG
SCHEMBL23218061 0.89 PTGER4 (0.43) CFDF11TPSB2KLKB1PLG
SCHEMBL23218163 0.86 CFD (0.52) CFDF11TPSB2ANO1PTGER4
SCHEMBL29592750 0.86 CFD (0.52) CFDF11TPSB2ANO1PTGER4
SCHEMBL23229010 0.86 CFD (0.52) CFDF11TPSB2ANO1PTGER4
SCHEMBL23218377 0.86 CFD (0.52) CFDF11TPSB2ANO1PTGER4
SCHEMBL29339604 0.85 P2RX3 (0.42) ANO1PTGER4MTNR1AMTNR1B
SCHEMBL23218533 0.85 CFD (0.43) CFDF11TPSB2KLKB1PLG
SCHEMBL23219215 0.85 CFD (0.52) CFDF11TPSB2ANO1PTGER4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021072198-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed