SCHEMBL2159156

SCHEMBL2159156

N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H]([C]=O)CCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ENPEP Q07075 5/20 0.52
OPRD1 P41143 10/20 0.47
NAALAD2 Q9Y3Q0 1/20 0.47
OPRM1 P35372 4/20 0.47
OPRK1 P41145 1/20 0.47
CCKAR P32238 3/20 0.46
CCKBR P32239 3/20 0.46

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
SCHEMBL2184691 0.89 NAALAD2 (0.47) ENPEPOPRD1NAALAD2OPRM1OPRK1
SCHEMBL2184747 0.86 MMP1 (0.51) NAALAD2
SCHEMBL10722419 0.85 OPRD1 (0.49) OPRD1OPRM1OPRK1
SCHEMBL30356631 0.84 ENPEP (0.62) ENPEPOPRD1NAALAD2OPRM1OPRK1
SCHEMBL2196939 0.84 PTPN1 (0.50) NAALAD2
SCHEMBL31668885 0.83 NAALAD2 (0.58) ENPEPOPRD1NAALAD2
SCHEMBL16468683 0.83 CTSC (0.56) NAALAD2
SCHEMBL29649767 0.83 NAALAD2 (0.68) ENPEPOPRD1NAALAD2OPRM1OPRK1
SCHEMBL3064613 0.83 BACE1 (0.45) ENPEPOPRD1NAALAD2
SCHEMBL30943981 0.83 ENPEP (0.57) ENPEPOPRD1NAALAD2

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-7985402-B2 Ultrasound contrast agent of peptide monomers; peptide vectors having high KDR binding affinity; gas filled microvesicle containing a fluorinated gas and a phospholipid BRACCO SUISSE SA (CH) 2011-07-26 US disclosed
US-20080152594-A1 TARGETING VECTOR-PHOSPHOLIPID CONJUGATES BRACCO SUISSE SA (CH) 2008-06-26 US disclosed