SCHEMBL744242

SCHEMBL744242

c1cnc2nc(Oc3ccc4c(C[AsH]C5CCNCC5)coc4c3)sc2c1

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 20/20 0.61

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
SCHEMBL3745097 0.84 LTA4H (0.61) LTA4H
SCHEMBL744910 0.82 LTA4H (0.83) LTA4H
Hydrochloric Acid SCHEMBL3744826 0.81 LTA4H (0.82) LTA4H
SCHEMBL744597 0.80 LTA4H (0.71) LTA4H
SCHEMBL3748603 0.80 LTA4H (0.71) LTA4H
SCHEMBL3477170 0.80 LTA4H (0.71) LTA4H
SCHEMBL3742258 0.80 LTA4H (0.67) LTA4H
SCHEMBL744517 0.79 LTA4H (0.84) LTA4H
Hydrochloric Acid SCHEMBL3753853 0.79 LTA4H (0.70) LTA4H
Hydrochloric Acid SCHEMBL742243 0.79 LTA4H (0.70) LTA4H

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