SCHEMBL745910

SCHEMBL745910

C[As](Cc1ccccc1)Cc1cc2cc(Oc3nc4ncccc4s3)ccc2o1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 20/20 0.61
KCNH2 Q12809 1/20 0.38

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
SCHEMBL743960 0.88 LTA4H (0.67) LTA4HKCNH2
SCHEMBL746968 0.85 LTA4H (0.66) LTA4HKCNH2
SCHEMBL745043 0.83 LTA4H (0.61) LTA4HKCNH2
SCHEMBL3753192 0.81 LTA4H (0.70) LTA4HKCNH2
SCHEMBL3748252 0.81 LTA4H (0.70) LTA4HKCNH2
SCHEMBL745072 0.81 LTA4H (0.67) LTA4HKCNH2
SCHEMBL746080 0.79 LTA4H (0.65) LTA4HKCNH2
SCHEMBL3745390 0.76 LTA4H (0.58) LTA4HKCNH2
SCHEMBL3745961 0.76 ALDH1A1 (0.52) LTA4HKCNH2
SCHEMBL745969 0.76 LTA4H (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2430019-A1 COMPOUNDS WITH TWO FUSED BICYCLIC HETEROARYL MOIETIES AS MODULATORS OF LEUKOTRIENE A4 HYDROLASE Janssen Pharmaceutica, N.V. (BE) 2012-03-21 EP claimed
WO-2010132599-A1 COMPOUNDS WITH TWO FUSED BICYCLIC HETEROARYL MOIETIES AS MODULATORS OF LEUKOTRIENE A4 HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2010-11-18 WO claimed