SCHEMBL5312396

SCHEMBL5312396

CC(C)N(CCN(Cc1c(C(=O)O)cccc1N(CCN(C)C)Cc1ccccc1)C(C)C)CC(=O)Nc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 15/20 0.49
NPY5R Q15761 4/20 0.41
UTS2R Q9UKP6 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
SCHEMBL5313807 0.77 LTA4H (0.69) LTA4H
SCHEMBL5662457 0.72 LTA4H (0.68) LTA4HNPY5R
SCHEMBL5661889 0.69 LTA4H (0.85) LTA4HNPY5R
SCHEMBL5659966 0.67 LTA4H (1.00) LTA4H
SCHEMBL5661307 0.67 LTA4H (0.65) LTA4HNPY5R
SCHEMBL5658771 0.67 LTA4H (0.56) LTA4HNPY5RUTS2R
SCHEMBL5660215 0.65 LTA4H (0.82) LTA4HNPY5R
SCHEMBL5312495 0.65 LTA4H (0.74) LTA4H
SCHEMBL5313799 0.65 MAPT (0.62) LTA4H
SCHEMBL5656997 0.65 LTA4H (0.62) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007079003-A2 AMIDE INHIBITORS OF LEUKOTRIENE A4 HYDROLASE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-07-12 WO claimed