SCHEMBL8529805

SCHEMBL8529805

Cc1c(C)c(S(=O)(=O)NC=N)c(C)c2c1OC(C)(C)CC2

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PLG P00747 2/20 0.39
F10 P00742 1/20 0.39
PLAU P00749 1/20 0.39
KLKB1 P03952 1/20 0.39
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
F2 P00734 1/20 0.34
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32

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
SCHEMBL18738617 0.86 HSP90AA1 (0.40) PLGF10PLAUKLKB1CYP1A2
SCHEMBL18545144 0.83 PLG (0.41) PLGF10PLAUKLKB1PTGS1
SCHEMBL4082092 0.82 PLG (0.41) PLGF10PLAUKLKB1PTGS1
SCHEMBL8531015 0.80 CYP1A2 (0.39) PLGF10PLAUKLKB1PTGS1
SCHEMBL8294965 0.79 CYP1A2 (0.43) PLGF10PLAUKLKB1PTGS1
SCHEMBL4431792 0.79 PLG (0.41) PLGF10PLAUKLKB1PTGS1
SCHEMBL18620596 0.79 PLG (0.41) PLGF10PLAUKLKB1PTGS1
SCHEMBL4434438 0.77 CYP1A2 (0.39) PLGF10PLAUKLKB1PTGS1
SCHEMBL838416 0.77 CYP1A2 (0.39) PLGF10PLAUKLKB1PTGS1
SCHEMBL4530181 0.77 PTGS1 (0.42) PLGF10PLAUKLKB1PTGS1

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
US-5807875-A OBESITY THERAPY DR. KARL THOMAE GMBH (DE) 1998-09-15 US disclosed