SCHEMBL2049355

SCHEMBL2049355

NC(=O)N1CC2CC1CN2CCOc1ccc(Oc2nc3ncccc3s2)cc1

nearest known ligand 0.85

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 20/20 0.85
KCNH2 Q12809 3/20 0.53

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
SCHEMBL1008977 1.00 LTA4H (0.85) LTA4HKCNH2
SCHEMBL1888282 1.00 LTA4H (0.85) LTA4HKCNH2
SCHEMBL1898474 0.92 LTA4H (1.00) LTA4HKCNH2
SCHEMBL29897047 0.92 LTA4H (1.00) LTA4HKCNH2
SCHEMBL1888398 0.92 LTA4H (1.00) LTA4HKCNH2
SCHEMBL1007663 0.92 LTA4H (1.00) LTA4HKCNH2
SCHEMBL1887903 0.90 LTA4H (0.85) LTA4HKCNH2
SCHEMBL15282370 0.90 LTA4H (0.85) LTA4HKCNH2
SCHEMBL1884362 0.90 LTA4H (0.85) LTA4HKCNH2
SCHEMBL12590544 0.89 LTA4H (0.77) LTA4HKCNH2

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
EP-2336125-A1 Thiazolopyridin-2-yloxy-phenyl and thiazolopyrazin-2-yloxy-phenyl amines as modulators of leukotriene A4 hydrolase Janssen Pharmaceutica N.V. (BE) 2011-06-22 EP disclosed