SCHEMBL7999637

SCHEMBL7999637

CCCCC(N)C(=O)N(C(=O)C(N)CC(C)C)C(Cc1ccccc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.51
RNPEP Q9H4A4 2/20 0.51
DNPEP Q9ULA0 2/20 0.51
LTA4H P09960 1/20 0.43
CTSK P43235 1/20 0.42
GPR88 Q9GZN0 1/20 0.42
ALPI P09923 1/20 0.41
PKM P14618 1/20 0.41
PTGS1 P23219 1/20 0.41
XIAP P98170 1/20 0.41
SLC7A5 Q01650 1/20 0.41
REN P00797 1/20 0.41
ACE P12821 1/20 0.40
SLC1A3 P43003 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40
GRIK1 P39086 1/20 0.40
CSNK1E P49674 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
SCHEMBL9242775 0.89 ANPEP (0.43) ANPEPRNPEPDNPEPLTA4HCTSK
SCHEMBL1128048 0.85 ANPEP (0.50) ANPEPRNPEPDNPEPLTA4HGPR88
SCHEMBL27468737 0.84 ANPEP (0.53) ANPEPRNPEPDNPEPLTA4HGPR88
SCHEMBL4398840 0.84 ANPEP (0.38) ANPEPRNPEPDNPEPLTA4HCTSK
Acetic Acid SCHEMBL15201184 0.83 ANPEP (0.48) ANPEPRNPEPDNPEPLTA4HGPR88
SCHEMBL7451833 0.83 ALPI (0.51) ANPEPRNPEPDNPEPLTA4HALPI
SCHEMBL19974077 0.82 ANPEP (0.51) ANPEPRNPEPDNPEPLTA4HGPR88
SCHEMBL6122992 0.81 SLC1A2 (0.50) ANPEPRNPEPDNPEPSLC7A5SLC1A3
SCHEMBL28786054 0.81 ANPEP (0.55) ANPEPRNPEPDNPEPLTA4HGPR88
SCHEMBL28786062 0.81 ANPEP (0.55) ANPEPRNPEPDNPEPLTA4HGPR88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0732944-A4 LABELED CHEMOTACTIC PEPTIDES TO IMAGE FOCAL SITES OF INFECTION OR INFLAMMATION GEN HOSPITAL CORP (US) 2000-06-07 EP disclosed
EP-0732944-A1 LABELED CHEMOTACTIC PEPTIDES TO IMAGE FOCAL SITES OF INFECTION OR INFLAMMATION THE GENERAL HOSPITAL CORPORATION (US) 1996-09-25 EP disclosed
WO-1995011045-A1 LABELED CHEMOTACTIC PEPTIDES TO IMAGE FOCAL SITES OF INFECTION OR INFLAMMATION THE GENERAL HOSPITAL CORPORATION (US) 1995-04-27 WO disclosed