SCHEMBL8637065

SCHEMBL8637065

CCCC1CCCCCN1Oc1ccc(Cc2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 10/20 0.44
HRH3 Q9Y5N1 2/20 0.43
SLC18A2 Q05940 1/20 0.40

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
SCHEMBL8639404 0.90 LTA4H (0.46) LTA4HHRH3
SCHEMBL8188491 0.77 NPC1 (0.50)
SCHEMBL1802067 0.75 LTA4H (0.58) LTA4HHRH3
SCHEMBL7246915 0.72 NPC1 (0.45)
SCHEMBL503024 0.71 NPC1 (0.39)
SCHEMBL7322832 0.71 SLC2A1 (0.59) LTA4HHRH3
SCHEMBL27996343 0.70 LTA4H (0.49) LTA4HHRH3
SCHEMBL27996276 0.70 LTA4H (0.49) LTA4HHRH3
Hydrochloric Acid SCHEMBL7321449 0.70 SLC2A1 (0.58) LTA4HHRH3
SCHEMBL7330703 0.70 HRH3 (0.52) LTA4HHRH3

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
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