SCHEMBL4775282

SCHEMBL4775282

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

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSK P43235 13/20 0.53
SLC15A1 P46059 1/20 0.42
CTSL P07711 4/20 0.41
CTSB P07858 4/20 0.41
DPP4 P27487 4/20 0.40
DPP9 Q86TI2 4/20 0.40
DPP7 Q9UHL4 4/20 0.40
DPP8 Q6V1X1 3/20 0.40
CTSH P09668 2/20 0.39
CTSS P25774 1/20 0.38
MMP3 P08254 1/20 0.37
MMP9 P14780 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
SCHEMBL4775289 1.00 CTSK (0.53) CTSKSLC15A1CTSLCTSBDPP4
SCHEMBL3326210 1.00 CTSK (0.53) CTSKSLC15A1CTSLCTSBDPP4
SCHEMBL3326212 1.00 CTSK (0.53) CTSKSLC15A1CTSLCTSBDPP4
SCHEMBL6031204 0.93 CTSK (0.59) CTSKSLC15A1CTSLCTSBDPP4
SCHEMBL8003112 0.93 CTSK (0.59) CTSKSLC15A1CTSLCTSBDPP4
SCHEMBL9572289 0.93 CTSK (0.59) CTSKSLC15A1CTSLCTSBDPP4
SCHEMBL4226584 0.92 CTSK (0.43) CTSKSLC15A1CTSLCTSBDPP4
SCHEMBL4226580 0.92 CTSK (0.43) CTSKSLC15A1CTSLCTSBDPP4
SCHEMBL1783728 0.86 CTSK (0.56) CTSKCTSLCTSBCTSHCTSS
SCHEMBL14876797 0.86 CTSK (0.56) CTSKCTSLCTSBCTSHCTSS

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-1994406-A1 METHODS FOR IDENTIFYING T-CELL EPITOPES ASSOCIATED WITH IMPAIRED PEPTIDE PROCESSING AND APPLICATIONS OF THE IDENTIFIED EPITOPES Leiden University Medical Center (NL) 2008-11-26 EP disclosed
WO-2007105954-A1 METHODS FOR IDENTIFYING T-CELL EPITOPES ASSOCIATED WITH IMPAIRED PEPTIDE PROCESSING AND APPLICATIONS OF THE IDENTIFIED EPITOPES LEIDEN UNIVERSITY MEDICAL CENTER (NL) 2007-09-20 WO disclosed