SCHEMBL29966464

SCHEMBL29966464

CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LNPEP Q9UIQ6 5/20 0.49
▸ ANPEP P15144 3/20 0.49
▸ SLC6A2 P23975 1/20 0.49
▸ AGTR1 P30556 1/20 0.49
▸ AGTR2 P50052 1/20 0.49
▸ NTSR1 P30989 10/20 0.48
▸ NTSR2 O95665 9/20 0.48
▸ SORT1 Q99523 7/20 0.48

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
SCHEMBL11212701 0.92 AGTR1 (0.54) LNPEPANPEPSLC6A2AGTR1AGTR2
SCHEMBL11212707 0.92 AGTR1 (0.54) LNPEPANPEPSLC6A2AGTR1AGTR2
SCHEMBL29602804 0.92 LNPEP (0.59) LNPEPANPEPAGTR1AGTR2NTSR1
SCHEMBL29701255 0.91 SLC6A2 (0.63) LNPEPANPEPSLC6A2AGTR1AGTR2
SCHEMBL11208028 0.90 AGTR1 (0.46) LNPEPANPEPSLC6A2AGTR1AGTR2
SCHEMBL29602954 0.86 C5AR1 (0.55) AGTR1AGTR2NTSR1NTSR2SORT1
SCHEMBL7291452 0.86 REN (0.51) LNPEPANPEPSLC6A2AGTR1AGTR2
SCHEMBL30798884 0.85 OPRM1 (0.51) SLC6A2
SCHEMBL30974302 0.85 SLC6A2 (0.50) LNPEPSLC6A2NTSR1NTSR2SORT1
SCHEMBL10066200 0.85 AGTR1 (0.62) LNPEPANPEPSLC6A2AGTR1AGTR2

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
CN-109553658-B Ang- (1-7) aza polypeptide analogue, preparation method and application 重庆大学 2022-10-04 — — CN claimed
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