SCHEMBL9258913

SCHEMBL9258913

O=C(O)c1cc2cc(OCc3cccc(C4(O)CC5COC(C4)O5)c3)ccc2c(-c2ccoc2)c1CO

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 20/20 0.71

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
SCHEMBL9259582 0.91 ALOX5 (0.58) ALOX5
SCHEMBL9260677 0.89 ALOX5 (0.61) ALOX5
SCHEMBL9261263 0.88 ALOX5 (0.58) ALOX5
SCHEMBL9267540 0.81 ALOX5 (0.47) ALOX5
SCHEMBL9136516 0.80 ALOX5 (0.47) ALOX5
SCHEMBL9136514 0.80 ALOX5 (0.47) ALOX5
SCHEMBL9285925 0.79 ALOX5 (0.51) ALOX5
SCHEMBL9390469 0.79 ALOX5 (0.47) ALOX5
SCHEMBL29519211 0.79 ALOX5 (1.00) ALOX5
SCHEMBL9300407 0.79 ALOX5 (1.00) ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5428060-A Useful as antiasthamatic, antiallergic, antiinflammatory and cytoprotective agent MERCK FROSST CANADA, INC. (CA) 1995-06-27 US claimed
US-5428060-A Useful as antiasthamatic, antiallergic, antiinflammatory and cytoprotective agent MERCK FROSST CANADA, INC. (CA) 1995-06-27 US disclosed
WO-1994005657-A1 HETEROARYLNAPHTHALENE HYDROXY ACIDS AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS MERCK FROSST CANADA INC. (CA) 1994-03-17 WO disclosed
US-5252599-A Antiasthma, antiallergens, antiinflammatory agents MERCK FROSST CANADA, INC. (CA) 1993-10-12 US disclosed