SCHEMBL8637140

SCHEMBL8637140

CCN1CCC(N)C1Oc1ccc(Cc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.45
LTA4H P09960 17/20 0.44
HRH3 Q9Y5N1 1/20 0.41

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
SCHEMBL8640176 0.84 HRH1 (0.45) HRH1LTA4HHRH3
SCHEMBL8641258 0.82 LTA4H (0.47) HRH1LTA4HHRH3
SCHEMBL8635920 0.80 LTA4H (0.43) HRH1LTA4HHRH3
SCHEMBL8639531 0.80 LTA4H (0.47) HRH1LTA4H
SCHEMBL8644364 0.80 LTA4H (0.48) HRH1LTA4H
SCHEMBL8641249 0.77 LTA4H (0.47) HRH1LTA4HHRH3
SCHEMBL8637445 0.75 HRH1 (0.46) HRH1LTA4HHRH3
SCHEMBL8641861 0.74 LTA4H (0.47) HRH1LTA4H
SCHEMBL8641938 0.74 LTA4H (0.52) HRH1LTA4H
SCHEMBL8639324 0.72 LTA4H (0.54) 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
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