SCHEMBL9159702

SCHEMBL9159702

OC1CCOC(c2cccc(COc3ccc4c(-c5ccoc5)ccnc4c3)c2)C1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 1/20 0.40
ALOX5 P09917 18/20 0.40
TLR8 Q9NR97 1/20 0.36

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
SCHEMBL9161437 0.90 GRM4 (0.39) GRM4ALOX5TLR8
SCHEMBL9161176 0.87 GRM4 (0.39) GRM4ALOX5TLR8
SCHEMBL9261102 0.83 MAOB (0.49) ALOX5
SCHEMBL9302861 0.81 ALOX5 (0.62) ALOX5
SCHEMBL9301706 0.81 ALOX5 (0.46) ALOX5
SCHEMBL9301699 0.80 ALOX5 (0.44) ALOX5
SCHEMBL9154909 0.80 ALOX5 (0.54) ALOX5
SCHEMBL9301510 0.80 ALOX5 (0.51) ALOX5
SCHEMBL9301723 0.78 ALOX5 (0.44) ALOX5
SCHEMBL9154676 0.77 GRM4 (0.38) GRM4ALOX5TLR8

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-5410054-A Heteroaryl quinolines as inhibitors of leukotriene biosynthesis MERCK FROSST CANADA, INC. (CA) 1995-04-25 US disclosed