SCHEMBL8528253

SCHEMBL8528253

CC(O)C(NC(=O)C(N)CS)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.52
PTGS1 P23219 1/20 0.47
SLC7A11 Q9UPY5 1/20 0.47
PDCD1LG2 Q9BQ51 1/20 0.45
CD274 Q9NZQ7 1/20 0.45
ACE P12821 1/20 0.41
FNTA P49354 7/20 0.39
FNTB P49356 7/20 0.39
ENPEP Q07075 2/20 0.39
CA2 P00918 2/20 0.38
CA1 P00915 1/20 0.38
PGGT1B P53609 1/20 0.37

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
SCHEMBL11324778 1.00 MME (0.52) MMEPTGS1SLC7A11PDCD1LG2CD274
SCHEMBL11324786 1.00 MME (0.52) MMEPTGS1SLC7A11PDCD1LG2CD274
SCHEMBL8528255 1.00 MME (0.52) MMEPTGS1SLC7A11PDCD1LG2CD274
SCHEMBL29351638 0.94 MME (0.48) MMEPTGS1SLC7A11PDCD1LG2CD274
SCHEMBL29793176 0.90 MME (0.46) MMEPTGS1SLC7A11PDCD1LG2CD274
SCHEMBL30272523 0.88 OPRM1 (0.46) MMEPDCD1LG2CD274ACEFNTA
SCHEMBL30603413 0.88 OPRM1 (0.46) MMEPDCD1LG2CD274ACEFNTA
SCHEMBL30811198 0.88 MMP1 (0.44) MMEPTGS1SLC7A11PDCD1LG2CD274
SCHEMBL6791478 0.87 MME (0.51) MMEPTGS1SLC7A11ACEFNTA
SCHEMBL6791475 0.87 MME (0.51) MMEPTGS1SLC7A11ACEFNTA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4294375-A1 METHODS OF LOADING EXTRACELLULAR VESICLES Lonza Sales AG (CH) 2023-12-27 EP disclosed
WO-2022178147-A1 METHODS OF LOADING EXTRACELLULAR VESICLES CODIAK BIOSCIENCES, INC. (US) 2022-08-25 WO disclosed
EP-0885899-A1 Method for obtaining peptide fragments by use of fluorinated organic acids SEIKO INSTRUMENTS INC. (JP) 1998-12-23 EP disclosed