SCHEMBL30604605

SCHEMBL30604605

N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.70
ECE1 P42892 9/20 0.65

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
SCHEMBL30386567 0.99 ACE (0.71) ACEECE1
SCHEMBL30011200 0.98 ACE (0.72) ACEECE1
SCHEMBL30011202 0.98 ACE (0.72) ACEECE1
SCHEMBL30011806 0.98 ACE (0.72) ACEECE1
SCHEMBL30010864 0.97 ACE (0.68) ACEECE1
SCHEMBL30011138 0.97 ACE (0.68) ACEECE1
SCHEMBL30011147 0.97 ACE (0.68) ACEECE1
SCHEMBL30011648 0.97 ACE (0.68) ACEECE1
SCHEMBL14957775 0.96 ACE (0.76) ACEECE1
SCHEMBL21828591 0.96 ACE (0.76) ACEECE1

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
CN-116836220-A Active peptide containing tryptophan and cysteine and application thereof 中山大学 2023-10-03 CN claimed
CN-116836220-A Active peptide containing tryptophan and cysteine and application thereof 中山大学 2023-10-03 CN disclosed