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SCHEMBL13082281

SCHEMBL13082281

CCC(C)C(NC(=O)CC(Cc1ccc(O)cc1)NC(=O)C(N)C(C)C)C(=O)NC(CC1CNC=N1)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LNPEP Q9UIQ6 6/20 0.56
▸ ANPEP P15144 3/20 0.56
▸ NTSR2 O95665 5/20 0.51
▸ NTSR1 P30989 5/20 0.51
▸ REN P00797 3/20 0.51
▸ AGTR1 P30556 1/20 0.51
▸ AGTR2 P50052 1/20 0.51
▸ SLC6A2 P23975 1/20 0.49
▸ SORT1 Q99523 3/20 0.47
▸ OPRD1 P41143 1/20 0.47

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
SCHEMBL13082089 0.90 NTSR2 (0.57) LNPEPANPEPNTSR2NTSR1REN
SCHEMBL13082279 0.90 LNPEP (0.57) LNPEPANPEPNTSR2NTSR1REN
SCHEMBL13081992 0.89 LNPEP (0.56) LNPEPANPEPNTSR2NTSR1REN
SCHEMBL4756875 0.86 LNPEP (0.60) LNPEPANPEPNTSR2NTSR1REN
SCHEMBL13081994 0.86 LNPEP (0.55) LNPEPANPEPNTSR2NTSR1REN
SCHEMBL13082283 0.84 AGTR1 (0.51) LNPEPANPEPNTSR2NTSR1REN
SCHEMBL13082276 0.84 NTSR1 (0.55) LNPEPANPEPNTSR2NTSR1REN
SCHEMBL13082278 0.84 LNPEP (0.53) LNPEPANPEPNTSR2NTSR1REN
SCHEMBL13081991 0.83 LNPEP (0.51) LNPEPANPEPRENSLC6A2OPRD1
SCHEMBL13082280 0.83 AGTR1 (0.53) LNPEPANPEPNTSR2NTSR1AGTR1

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-2010133806-A2 MARKED PEPTIDES AND USE THEREOF FOR ASSAYING CIRCULATING IRAP UNIVERSITE JOSEPH FOURIER (FR) 2010-11-25 — — WO disclosed
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