SCHEMBL29802129

SCHEMBL29802129

C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.52
NTSR2 O95665 1/20 0.44
NTSR1 P30989 1/20 0.44
OPRK1 P41145 1/20 0.43
REN P00797 1/20 0.43

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
SCHEMBL29802097 0.96 ACE (0.50) ACENTSR2NTSR1OPRK1REN
SCHEMBL29802040 0.95 ACE (0.52) ACENTSR2NTSR1OPRK1
SCHEMBL29801920 0.95 ACE (0.52) ACENTSR2NTSR1OPRK1REN
SCHEMBL29801802 0.93 ACE (0.56) ACEOPRK1REN
SCHEMBL29802185 0.92 ACE (0.50) ACENTSR2NTSR1OPRK1REN
SCHEMBL29801996 0.92 ACE (0.47) ACENTSR2NTSR1
SCHEMBL29802427 0.91 ACE (0.52) ACEOPRK1REN
SCHEMBL29802055 0.91 ACE (0.52) ACEOPRK1REN
SCHEMBL29801987 0.91 ACE (0.52) ACEOPRK1REN
SCHEMBL29802301 0.91 ACE (0.49) ACENTSR2NTSR1OPRK1

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
EP-4306534-A1 MULTIFUNCTIONAL POLYPEPTIDE AND APPLICATION THEREOF IN FIELD OF MEDICINES Wuhan Innerse Pharmaceutical Inc. (CN) 2024-01-17 EP disclosed
WO-2022188878-A1 MULTIFUNCTIONAL POLYPEPTIDE AND APPLICATION THEREOF IN FIELD OF MEDICINES 武汉英纳氏药业有限公司 2022-09-15 WO disclosed