SCHEMBL29440233

SCHEMBL29440233

C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.48
LTA4H P09960 2/20 0.41
CTSD P07339 1/20 0.40
BACE1 P56817 1/20 0.40
ACE P12821 1/20 0.38
CPA1 P15085 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
GNPAT O15228 1/20 0.38
PTPN1 P18031 1/20 0.36

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
SCHEMBL31307914 0.91 BACE1 (0.45) MMECTSDBACE1
SCHEMBL30797948 0.90 GNPAT (0.46) MMELTA4HCTSDBACE1ACE
SCHEMBL29874706 0.90 MME (0.52) MMELTA4HCTSDBACE1GNPAT
SCHEMBL29696975 0.89 BACE1 (0.44) MMECTSDBACE1ACECPA1
SCHEMBL30068583 0.89 BACE1 (0.44) MMECTSDBACE1ACECPA1
SCHEMBL30552861 0.89 MME (0.41) MMELTA4HCTSDBACE1ACE
SCHEMBL3341838 0.88 LTA4H (0.49) MMELTA4HACECPA1ACE2
SCHEMBL10494263 0.88 LTA4H (0.49) MMELTA4HACECPA1ACE2
SCHEMBL2807590 0.88 LTA4H (0.49) MMELTA4HACECPA1ACE2
SCHEMBL4957790 0.88 LTA4H (0.49) MMELTA4HACECPA1ACE2

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
US-20220251157-A1 IgM-MEDIATED RECEPTOR CLUSTERING AND CELL MODULATION MAYO FOUND MEDICAL EDUCATION & RES (US) 2022-08-11 US disclosed
US-11274131-B2 IgM-mediated receptor clustering and cell modulation MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2022-03-15 US disclosed