SCHEMBL9866064

SCHEMBL9866064

O=C(Nc1ccc(OCc2ccc3ccccc3n2)cc1)NS(=O)(=O)Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 1/20 0.57
FFAR1 O14842 1/20 0.55
AKR1B1 P15121 1/20 0.55
CYSLTR1 Q9Y271 9/20 0.55
CYSLTR2 Q9NS75 4/20 0.55
PDE10A Q9Y233 2/20 0.52
MET P08581 1/20 0.52
ALOX5 P09917 1/20 0.51

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
SCHEMBL9866170 0.99 GPBAR1 (0.56) GPBAR1FFAR1AKR1B1CYSLTR1CYSLTR2
SCHEMBL9865885 0.86 GPBAR1 (0.57) GPBAR1FFAR1AKR1B1CYSLTR1CYSLTR2
SCHEMBL9876648 0.81 CYSLTR2 (0.60) GPBAR1CYSLTR1CYSLTR2PDE10AALOX5
SCHEMBL9876878 0.81 CYSLTR2 (0.52) GPBAR1FFAR1AKR1B1CYSLTR1CYSLTR2
SCHEMBL7008427 0.79 GPBAR1 (0.64) GPBAR1FFAR1AKR1B1CYSLTR1CYSLTR2
SCHEMBL6468349 0.78 PGR (0.62) MET
SCHEMBL7753530 0.77 CYSLTR1 (0.54) GPBAR1FFAR1AKR1B1CYSLTR1CYSLTR2
SCHEMBL9719811 0.77 GPBAR1 (0.62) GPBAR1FFAR1AKR1B1CYSLTR1CYSLTR2
SCHEMBL9121462 0.77 CYSLTR1 (0.54) GPBAR1FFAR1AKR1B1CYSLTR1CYSLTR2
SCHEMBL9866191 0.77 CYSLTR2 (0.54) GPBAR1FFAR1AKR1B1CYSLTR1CYSLTR2

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 2 patents. 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 claimed
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