SCHEMBL7816672

SCHEMBL7816672

CCC(O)(c1cccc(CO[Si](C)(C)C(C)(C)C)n1)c1nccs1

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 18/20 0.42
IRAK4 Q9NWZ3 1/20 0.35

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
SCHEMBL7812680 0.83 ALOX5 (0.46) ALOX5IRAK4
SCHEMBL7803741 0.82 ALOX5 (0.44) ALOX5
SCHEMBL7813031 0.76 ALOX5 (0.45) ALOX5
SCHEMBL536722 0.75 HCRTR1 (0.41) IRAK4
SCHEMBL20416874 0.74 IRAK4 (0.34) IRAK4
SCHEMBL2037282 0.73 ALOX5 (0.48) ALOX5
SCHEMBL23355664 0.72 IRAK4 (0.33) IRAK4
SCHEMBL20436450 0.72 KCNH2 (0.34) IRAK4
SCHEMBL9375328 0.72 ALOX5 (0.62) ALOX5
SCHEMBL21790628 0.71 ADORA2A (0.43) IRAK4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0788497-B1 BISARYLCARBINOL DERIVATIVES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS MERCK FROSST CANADA INC (CA) 2001-05-23 EP disclosed
US-5552437-A ANTIASTHMATIC, ANTIALLERGIC, ANTIINFLAMMATORY, AND CYTOPROTECTIVE AGENTS MERCK FROSST CANADA, INC. (CA) 1996-09-03 US disclosed
WO-1996013500-A1 BISARYLCARBINOL DERIVATIVES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS MERCK FROSST CANADA INC. (CA) 1996-05-09 WO disclosed