SCHEMBL23217894

SCHEMBL23217894

CCOC(=O)Cc1ccccc1OCc1cc(-c2cccc(C=NS(=O)(=O)NC(C)(C)C)c2)c2occc2c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CFD P00746 14/20 0.51
SYK P43405 1/20 0.32
PTGER1 P34995 2/20 0.32
PTGER4 P35408 2/20 0.32
PTGER3 P43115 2/20 0.32
PTGER2 P43116 2/20 0.32
F11 P03951 3/20 0.31
TPSB2 P20231 3/20 0.31
PLG P00747 1/20 0.31
PLAU P00749 1/20 0.31
KLKB1 P03952 1/20 0.31
F7 P08709 1/20 0.31
TBXAS1 P24557 1/20 0.31
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 1/20 0.31

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
SCHEMBL23217893 1.00 CFD (0.51) CFDSYKPTGER1PTGER4PTGER3
SCHEMBL23217871 0.86 CFD (0.42) CFDSYKTBXAS1
SCHEMBL23217872 0.86 CFD (0.42) CFDSYKTBXAS1
SCHEMBL23217874 0.86 CFD (0.45) CFDTBXAS1
SCHEMBL23217873 0.86 CFD (0.45) CFDTBXAS1
SCHEMBL23241531 0.84 CFD (0.53) CFDSYKPTGER1PTGER4PTGER3
SCHEMBL28772685 0.84 CFD (0.53) CFDSYKPTGER1PTGER4PTGER3
SCHEMBL28772820 0.82 CFD (0.41) CFDSYKPTGER1
SCHEMBL23217681 0.81 CFD (0.57) CFDPTGER1PTGER4PTGER3PTGER2
SCHEMBL23217682 0.81 CFD (0.57) CFDPTGER1PTGER4PTGER3PTGER2

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-2021072156-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed