SCHEMBL9865146

SCHEMBL9865146

c1ccc2nc(COc3ccc(NC4CCCC4)cc3)ccc2c1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 6/20 0.59
CYSLTR2 Q9NS75 5/20 0.59
ALOX5 P09917 10/20 0.59
HDAC6 Q9UBN7 1/20 0.59
GPBAR1 Q8TDU6 1/20 0.53
PDE10A Q9Y233 1/20 0.52
ALOX5AP P20292 1/20 0.52

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
SCHEMBL9018917 0.83 CYSLTR1 (0.57) CYSLTR1CYSLTR2ALOX5HDAC6GPBAR1
SCHEMBL9867329 0.82 CYSLTR1 (0.56) CYSLTR1CYSLTR2ALOX5HDAC6GPBAR1
SCHEMBL8503501 0.81 CYSLTR1 (0.66) CYSLTR1CYSLTR2ALOX5HDAC6GPBAR1
SCHEMBL10438460 0.80 CYSLTR1 (0.65) CYSLTR1CYSLTR2ALOX5HDAC6GPBAR1
SCHEMBL10438395 0.80 CYSLTR1 (0.65) CYSLTR1CYSLTR2ALOX5HDAC6GPBAR1
SCHEMBL10438455 0.80 CYSLTR1 (0.65) CYSLTR1CYSLTR2ALOX5HDAC6GPBAR1
SCHEMBL1695058 0.79 CYSLTR1 (0.69) CYSLTR1CYSLTR2ALOX5GPBAR1PDE10A
SCHEMBL3271578 0.79 CYSLTR1 (0.69) CYSLTR1CYSLTR2ALOX5GPBAR1PDE10A
SCHEMBL8965425 0.79 CYSLTR1 (0.64) CYSLTR1CYSLTR2ALOX5HDAC6GPBAR1
SCHEMBL10521151 0.78 ALOX5 (0.69) ALOX5HDAC6

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 disclosed
EP-0387610-A2 Substituted (quinolin-2-yl methoxy)phenyl-N,N'-sulphonyl ureas, processes for their preparation and their use in medicines BAYER AG (DE) 1990-09-19 EP disclosed