SCHEMBL9018914

SCHEMBL9018914

NC(c1ccc(OCc2ccc3ccccc3n2)cc1)C1CCCC1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 19/20 0.69
HDAC6 Q9UBN7 1/20 0.69
CYSLTR2 Q9NS75 1/20 0.57
CYSLTR1 Q9Y271 1/20 0.57

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
SCHEMBL7234994 0.99 ALOX5 (0.70) ALOX5HDAC6
SCHEMBL8799865 0.87 ALOX5 (0.73) ALOX5HDAC6
SCHEMBL10521151 0.86 ALOX5 (0.69) ALOX5HDAC6
SCHEMBL8801108 0.86 ALOX5 (0.69) ALOX5HDAC6
SCHEMBL8800680 0.85 ALOX5 (0.67) ALOX5HDAC6
SCHEMBL8801130 0.85 ALOX5 (0.67) ALOX5HDAC6
SCHEMBL8965421 0.85 ALOX5 (0.73) ALOX5HDAC6
SCHEMBL10520188 0.85 ALOX5 (0.70) ALOX5HDAC6
SCHEMBL8965314 0.84 ALOX5 (0.66) ALOX5HDAC6
SCHEMBL8965126 0.84 ALOX5 (0.70) ALOX5HDAC6CYSLTR1

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
EP-0414019-B1 Subsituted N-(quinolin-2-yl-methoxy)benzylsulfonylureas BAYER AG (DE) 1996-05-29 EP disclosed
US-5179106-A SUBSTITUTED N-(QUINOLIN-2-YL-METHOXY) BENZYL-SULPHONYLUREA LEUKOTRIENE SYNTHESIS INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 1993-01-12 US disclosed