SCHEMBL744241

SCHEMBL744241

[AsH2]C1CCN(Cc2coc3cc(Oc4nc5ncccc5s4)ccc23)CC1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 20/20 0.81
KCNH2 Q12809 1/20 0.51

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
SCHEMBL743938 0.92 LTA4H (0.84) LTA4HKCNH2
SCHEMBL745947 0.91 LTA4H (0.81) LTA4HKCNH2
SCHEMBL745918 0.91 LTA4H (0.81) LTA4HKCNH2
SCHEMBL745294 0.91 LTA4H (0.82) LTA4HKCNH2
Hydrochloric Acid SCHEMBL3744812 0.91 LTA4H (0.79) LTA4HKCNH2
SCHEMBL743540 0.90 LTA4H (0.98) LTA4HKCNH2
SCHEMBL743430 0.90 LTA4H (0.79) LTA4HKCNH2
SCHEMBL744978 0.90 LTA4H (0.78) LTA4HKCNH2
SCHEMBL745349 0.89 LTA4H (1.00) LTA4H
SCHEMBL745562 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 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