SCHEMBL8644161

SCHEMBL8644161

O=C(O)C1CCN(CCOc2ccc(Cc3ccccc3)cc2)C1

nearest known ligand 0.86

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 20/20 0.86

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
SCHEMBL1002589 0.93 LTA4H (1.00) LTA4H
SCHEMBL7138031 0.91 LTA4H (1.00) LTA4H
SCHEMBL7139740 0.89 LTA4H (1.00) LTA4H
SCHEMBL947836 0.86 LTA4H (0.64) LTA4H
SCHEMBL7140388 0.85 LTA4H (1.00) LTA4H
SCHEMBL7137384 0.84 LTA4H (0.87) LTA4H
SCHEMBL7140846 0.84 LTA4H (1.00) LTA4H
SCHEMBL7141718 0.83 LTA4H (1.00) LTA4H
SCHEMBL8635915 0.83 LTA4H (0.83) LTA4H
SCHEMBL7138681 0.83 LTA4H (0.82) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0804427-A1 LTA4 HYDROLASE INHIBITORS G.D. SEARLE & CO. (US) 1997-11-05 EP claimed
WO-1996011192-A1 LTA4 HYDROLASE INHIBITORS G.D. SEARLE & CO. (US) 1996-04-18 WO claimed
US-5723492-A LTA4 hydrolase inhibitor pharmaceutical compositions and methods of use G.D. SEARLE & CO. (US) 1998-03-03 US disclosed
US-5719306-A ANTIINFLAMMATORY AGENTS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed
EP-0804427-A1 LTA4 HYDROLASE INHIBITORS G.D. SEARLE & CO. (US) 1997-11-05 EP disclosed
WO-1996011192-A1 LTA4 HYDROLASE INHIBITORS G.D. SEARLE & CO. (US) 1996-04-18 WO disclosed