SCHEMBL9668698

SCHEMBL9668698

CC(NC(=O)NCO)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACACB O00763 5/20 0.63
F7 P08709 1/20 0.58
ACACA Q13085 1/20 0.54
EPHX2 P34913 2/20 0.52
ALOX5 P09917 1/20 0.52
LTA4H P09960 1/20 0.50

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
SCHEMBL9685836 0.87 ACACB (0.66) ACACBF7ACACAALOX5LTA4H
SCHEMBL9686116 0.80 ACACB (0.67) ACACBACACAALOX5LTA4H
SCHEMBL9474891 0.79 ACACB (0.65) ACACBF7ACACAALOX5LTA4H
SCHEMBL9398051 0.78 ACACB (0.60) ACACBALOX5LTA4H
SCHEMBL3425496 0.77 ACACB (0.64) ACACBF7ACACAALOX5LTA4H
SCHEMBL10426966 0.76 ACACB (0.58) ACACBALOX5LTA4H
SCHEMBL2885897 0.75 ALOX5 (0.62) ACACBALOX5LTA4H
SCHEMBL8833698 0.75 ALOX5 (0.62) ACACBALOX5LTA4H
Hydrochloric Acid SCHEMBL7913851 0.75 ACACB (0.56) ACACBALOX5LTA4H
SCHEMBL2299041 0.74 MAOB (0.56) ACACBF7ALOX5LTA4H

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-0456760-A4 LIPOXYGENASE INHIBITING COMPOUNDS 1992-01-08 EP claimed
EP-0456760-A1 LIPOXYGENASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1991-11-21 EP claimed