SCHEMBL9541385

SCHEMBL9541385

Cc1occc1COC(C)CN(O)C(N)=O

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 14/20 0.59
HPGD P15428 2/20 0.33
GAA P10253 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL9539718 0.79 ALOX5 (0.59) ALOX5ALDH1A1MAPT
SCHEMBL9584897 0.77 ALOX5 (0.56) ALOX5HPGDGAAALDH1A1MAPT
SCHEMBL9539758 0.75 ALOX5 (0.58) ALOX5MAPT
SCHEMBL9538808 0.75 ALOX5 (0.56) ALOX5
SCHEMBL9539835 0.75 ALOX5 (0.43) ALOX5ALDH1A1
SCHEMBL9539663 0.72 SLC1A3 (0.57) ALOX5ALDH1A1
SCHEMBL9539698 0.69 SLC1A3 (0.57) ALOX5ALDH1A1
SCHEMBL9539727 0.68 ALOX5 (0.56) ALOX5ALDH1A1MAPTTSHR
SCHEMBL7334644 0.65 ALOX5 (0.59) ALOX5HPGDGAAALDH1A1MAPT
SCHEMBL9584855 0.65 ALOX5 (0.52) ALOX5MAPT

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
WO-1993003719-A1 ARYLALKYLETHER AND ARYLALKYLTHIOETHER INHIBITORS OF LIPOXYGENASE ENZYME ACTIVITY ABBOTT LABORATORIES (US) 1993-03-04 WO claimed
US-5183818-A Also for inhibiting leukotriene biosynthesis ABBOTT LABORATORIES (US) 1993-02-02 US disclosed