SCHEMBL9138182

SCHEMBL9138182

Cn1c(=O)ccc2cc(COc3cc(F)cc(C4(O)CC5CCC(C4)O5)c3)ccc21

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 20/20 0.73

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
SCHEMBL9138701 0.89 ALOX5 (0.68) ALOX5
SCHEMBL9256165 0.84 ALOX5 (1.00) ALOX5
SCHEMBL9393525 0.79 ALOX5 (0.79) ALOX5
SCHEMBL9393536 0.79 ALOX5 (0.79) ALOX5
SCHEMBL9135113 0.78 ALOX5 (0.80) ALOX5
Zd-2138 SCHEMBL29372755 0.78 ALOX5 (1.00) ALOX5
Zd-2138 SCHEMBL1083603 0.78 ALOX5 (1.00) ALOX5
SCHEMBL9216159 0.77 ALOX5 (0.79) ALOX5
SCHEMBL9136252 0.77 ALOX5 (1.00) ALOX5
SCHEMBL9219847 0.77 ALOX5 (0.79) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5459271-A Arylbicyclooctanes as inhibitors of leukotriene biosynthesis MERCK FROSST CANADA, INC. (CA) 1995-10-17 US disclosed