SCHEMBL7032099

SCHEMBL7032099

CCCCC(=O)N(C(=O)C(N)CC(C)C)C(Cc1ccccc1S)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.37
RNPEP Q9H4A4 1/20 0.37
DNPEP Q9ULA0 1/20 0.37
MMP1 P03956 2/20 0.36
PSMB5 P28074 1/20 0.33
LTB4R2 Q9NPC1 5/20 0.33
LTA4H P09960 1/20 0.33
ACE P12821 1/20 0.33
LARS1 Q9P2J5 1/20 0.33
GPR88 Q9GZN0 1/20 0.32
SLC7A5 Q01650 1/20 0.32
REN P00797 1/20 0.31

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
SCHEMBL7028027 0.88 ANPEP (0.43) ANPEPRNPEPDNPEPMMP1LTA4H
SCHEMBL7028776 0.86 ANPEP (0.34) ANPEPRNPEPDNPEPPSMB5LTB4R2
SCHEMBL7029135 0.86 MMP2 (0.36) ANPEPLTB4R2LTA4H
SCHEMBL7032152 0.85 MARS1 (0.35)
SCHEMBL7029892 0.77 MMP2 (0.37) ANPEPRNPEPDNPEPLTA4HREN
SCHEMBL4398840 0.76 ANPEP (0.38) ANPEPRNPEPDNPEPLTA4HLARS1
SCHEMBL7031217 0.75 MARS1 (0.36)
SCHEMBL7999637 0.75 ANPEP (0.51) ANPEPRNPEPDNPEPLTA4HACE
SCHEMBL7030791 0.74 ANPEP (0.40) ANPEPRNPEPDNPEPLTB4R2LTA4H
SCHEMBL19974077 0.73 ANPEP (0.51) ANPEPRNPEPDNPEPLTA4HACE

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140984-B1 SELECTIVE INHIBITORS OF MMP-12 AVENTIS PHARMA INC (US) 2003-02-12 EP disclosed
US-6352976-B1 ENZYME INHIBITORS OF MATRIX METALLOPROTEINASE FOR EMPHYSEMA AVENTIS PHARMACEUTICALS INC. 2002-03-05 US disclosed
EP-1140984-A1 SELECTIVE INHIBITORS OF MMP-12 Aventis Pharmaceuticals Inc. (US) 2001-10-10 EP disclosed
WO-2000040600-A1 SELECTIVE INHIBITORS OF MMP-12 AVENTIS PHARMACEUTICALS INC. (US) 2000-07-13 WO disclosed