SCHEMBL23217548

SCHEMBL23217548

CC(C)(C)[S+]([O-])N=Cc1cc(-c2cc(COc3ccccc3CC(=O)O)cc3ccoc23)co1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CFD P00746 20/20 0.58
F11 P03951 9/20 0.42
TPSB2 P20231 7/20 0.42
KLKB1 P03952 4/20 0.40
PLG P00747 1/20 0.40
PLAU P00749 1/20 0.40
F7 P08709 1/20 0.40

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
SCHEMBL23217547 1.00 CFD (0.58) CFDF11TPSB2KLKB1PLG
SCHEMBL30009740 0.91 CFD (0.48) CFDF11TPSB2KLKB1PLG
SCHEMBL23241532 0.91 CFD (0.48) CFDF11TPSB2KLKB1PLG
SCHEMBL23217682 0.84 CFD (0.57) CFDF11TPSB2KLKB1PLG
SCHEMBL23217681 0.84 CFD (0.57) CFDF11TPSB2KLKB1PLG
SCHEMBL28943908 0.84 CFD (0.53) CFDF11TPSB2KLKB1PLG
SCHEMBL28772773 0.82 CFD (0.61) CFDF11TPSB2KLKB1PLG
SCHEMBL28772685 0.81 CFD (0.53) CFDF11TPSB2KLKB1PLG
SCHEMBL23241531 0.81 CFD (0.53) CFDF11TPSB2KLKB1PLG
SCHEMBL28772753 0.79 CFD (0.47) CFDF11TPSB2

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