SCHEMBL23218593

SCHEMBL23218593

NCc1cccc(-c2cc(C(O)C(F)(F)F)c3occ(COc4ccccc4CC(=O)O)c3c2)c1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CFD P00746 19/20 0.58
F11 P03951 10/20 0.58
TPSB2 P20231 9/20 0.58
PLAU P00749 2/20 0.58
KLKB1 P03952 2/20 0.58
PLG P00747 1/20 0.58
F7 P08709 1/20 0.58

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
SCHEMBL29853183 1.00 CFD (0.58) CFDF11TPSB2PLAUKLKB1
SCHEMBL23219187 0.90 CFD (0.62) CFDF11TPSB2PLAUKLKB1
SCHEMBL29852721 0.90 CFD (0.62) CFDF11TPSB2PLAUKLKB1
SCHEMBL29852551 0.90 CFD (0.47) CFDF11TPSB2PLAUKLKB1
SCHEMBL23218725 0.90 CFD (0.47) CFDF11TPSB2PLAUKLKB1
SCHEMBL23219155 0.87 CFD (0.62) CFDF11TPSB2PLAUKLKB1
SCHEMBL29852840 0.87 CFD (0.62) CFDF11TPSB2PLAUKLKB1
SCHEMBL29852697 0.85 CFD (0.57) CFDF11TPSB2PLAUKLKB1
SCHEMBL23218793 0.85 CFD (0.57) CFDF11TPSB2PLAUKLKB1
SCHEMBL23218224 0.85 CFD (0.66) CFDF11TPSB2PLAUKLKB1

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