SCHEMBL4226580

SCHEMBL4226580

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.43
CTSS P25774 3/20 0.38
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
CTSC P53634 1/20 0.36
SLC7A5 Q01650 1/20 0.35
PSMB1 P20618 1/20 0.35
PSMB5 P28074 1/20 0.35
PSMB2 P49721 1/20 0.35
SLC15A1 P46059 1/20 0.35
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
NPY4R P50391 2/20 0.34
NPY1R P25929 1/20 0.34
ANPEP P15144 2/20 0.34
RNPEP Q9H4A4 2/20 0.34
DNPEP Q9ULA0 1/20 0.34
BIRC2 Q13490 1/20 0.34

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
SCHEMBL4226584 1.00 CTSK (0.43) CTSKCTSSCTSLCTSBCTSC
SCHEMBL3678078 0.93 CTSK (0.48) CTSKCTSLCTSBSLC7A5SLC15A1
SCHEMBL3678079 0.93 CTSK (0.48) CTSKCTSLCTSBSLC7A5SLC15A1
SCHEMBL4775289 0.92 CTSK (0.53) CTSKCTSSCTSLCTSBSLC15A1
SCHEMBL4775282 0.92 CTSK (0.53) CTSKCTSSCTSLCTSBSLC15A1
SCHEMBL3326210 0.92 CTSK (0.53) CTSKCTSSCTSLCTSBSLC15A1
SCHEMBL3326212 0.92 CTSK (0.53) CTSKCTSSCTSLCTSBSLC15A1
SCHEMBL30091429 0.90 CTSK (0.44) CTSKCTSSCTSLCTSBCTSC
SCHEMBL30091426 0.89 DPP4 (0.46) CTSKDPP4DPP8DPP9MMP3
SCHEMBL13039705 0.88 CAPN1 (0.41) CTSLCTSBSLC7A5PSMB1PSMB5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009152462-A2 METHOD OF REGULATING CELL GROWTH USING A PROTEASOME INHIBITOR THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2009-12-17 WO disclosed