SCHEMBL9876648

SCHEMBL9876648

Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc(OCc3ccc4ccccc4n3)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.60
CYSLTR1 Q9Y271 2/20 0.60
ADAMTS4 O75173 1/20 0.56
LMNA P02545 1/20 0.55
HRH3 Q9Y5N1 2/20 0.52
GPBAR1 Q8TDU6 1/20 0.51
GFER P55789 1/20 0.50
TP53 P04637 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
CA5A P35218 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA13 Q8N1Q1 1/20 0.50
CA14 Q9ULX7 1/20 0.50
PDE10A Q9Y233 3/20 0.49
MEN1 O00255 1/20 0.49

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
SCHEMBL9865792 0.90 CYSLTR1 (0.56) CYSLTR2CYSLTR1LMNAGPBAR1TP53
SCHEMBL9876878 0.86 CYSLTR2 (0.52) CYSLTR2CYSLTR1ADAMTS4GPBAR1CA12
SCHEMBL9865885 0.86 GPBAR1 (0.57) CYSLTR2CYSLTR1ADAMTS4GPBAR1PDE10A
SCHEMBL5184799 0.81 AR (0.70) LMNAHRH3TP53CA12CA1
SCHEMBL9866064 0.81 GPBAR1 (0.57) CYSLTR2CYSLTR1GPBAR1PDE10AALOX5
SCHEMBL9018929 0.81 CYSLTR2 (0.54) CYSLTR2CYSLTR1ADAMTS4LMNAGPBAR1
SCHEMBL9866170 0.80 GPBAR1 (0.56) CYSLTR2CYSLTR1GPBAR1PDE10AALOX5
SCHEMBL3362235 0.80 CYSLTR1 (0.63) CYSLTR2CYSLTR1ADAMTS4GPBAR1
SCHEMBL9508040 0.79 CYSLTR1 (0.60) CYSLTR2CYSLTR1ADAMTS4ALOX5
SCHEMBL7008427 0.79 GPBAR1 (0.64) CYSLTR2CYSLTR1GPBAR1PDE10AMEN1

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