SCHEMBL9865869

SCHEMBL9865869

CCCCCN(C(=O)NS(=O)(=O)c1ccc(C)cc1)c1ccc(OCc2ccc3ccccc3n2)cc1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 7/20 0.57
CYSLTR2 Q9NS75 4/20 0.55
CYSLTR1 Q9Y271 4/20 0.55
ADAMTS4 O75173 1/20 0.50
GPBAR1 Q8TDU6 3/20 0.46
ALOX5 P09917 2/20 0.45
GFER P55789 1/20 0.44

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
SCHEMBL9865777 0.88 PDE10A (0.59) PDE10ACYSLTR2CYSLTR1ADAMTS4GPBAR1
SCHEMBL9866285 0.88 PDE10A (0.62) PDE10ACYSLTR2CYSLTR1GPBAR1ALOX5
SCHEMBL9866102 0.81 CYSLTR2 (0.52) PDE10ACYSLTR2CYSLTR1ADAMTS4ALOX5
SCHEMBL9876648 0.78 CYSLTR2 (0.60) PDE10ACYSLTR2CYSLTR1ADAMTS4GPBAR1
SCHEMBL9018929 0.78 CYSLTR2 (0.54) PDE10ACYSLTR2CYSLTR1ADAMTS4GPBAR1
SCHEMBL9865805 0.76 CYSLTR1 (0.48) PDE10ACYSLTR2CYSLTR1ADAMTS4GPBAR1
SCHEMBL3362235 0.74 CYSLTR1 (0.63) CYSLTR2CYSLTR1ADAMTS4GPBAR1
SCHEMBL9866291 0.73 CYSLTR1 (0.52) PDE10ACYSLTR2CYSLTR1ADAMTS4GPBAR1
SCHEMBL9508040 0.73 CYSLTR1 (0.60) CYSLTR2CYSLTR1ADAMTS4ALOX5
SCHEMBL7751226 0.73 CYSLTR2 (0.57) PDE10ACYSLTR2CYSLTR1ADAMTS4GPBAR1

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-5045547-A Leukotriene-inhibiting substituted (quinolin-2-yl-methoxy)phenyl-N,N'-sulphonylureas and use thereas BAYER AKTIENGESELLSCHAFT (DE) 1991-09-03 US disclosed