SCHEMBL7922664

SCHEMBL7922664

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

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.41
BACE1 P56817 1/20 0.41
FURIN P09958 4/20 0.41
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
GSR P00390 1/20 0.39
GNAI3 P08754 1/20 0.36
GNAO1 P09471 1/20 0.36
GNAI1 P63096 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
SCHEMBL7922670 1.00 CTSD (0.41) CTSDBACE1FURINDPP8DPP9
SCHEMBL29366972 0.93 GSR (0.41) FURINDPP8DPP9DPP7GSR
SCHEMBL29404549 0.91 ACE (0.46) FURINDPP8DPP9DPP7GSR
SCHEMBL28220840 0.91 GSR (0.47) CTSDBACE1FURINDPP8DPP9
SCHEMBL28220832 0.91 GSR (0.47) CTSDBACE1FURINDPP8DPP9
SCHEMBL31472967 0.90 DPP8 (0.39) FURINDPP8DPP9DPP7GSR
SCHEMBL29527624 0.90 ACE (0.43) FURINDPP8DPP9DPP7GSR
SCHEMBL31609083 0.90 BACE1 (0.42) CTSDBACE1FURINDPP8DPP9
SCHEMBL30361652 0.88 BACE1 (0.45) CTSDBACE1FURIN
SCHEMBL676551 0.88 BACE1 (0.45) CTSDBACE1FURIN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1225171-A Direct electrochemistry of enzymes BRITISH GAS PLC (GB) 1999-08-04 CN claimed
EP-0897537-A1 DIRECT ELECTROCHEMISTRY OF ENZYMES BG plc (GB) 1999-02-24 EP claimed
WO-1997043632-A1 DIRECT ELECTROCHEMISTRY OF ENZYMES BG PLC (GB) 1997-11-20 WO claimed
US-6231746-B1 MONOOXYGENASE BG PLC (GB) 2001-05-15 US disclosed
CN-1225171-A Direct electrochemistry of enzymes BRITISH GAS PLC (GB) 1999-08-04 CN disclosed
EP-0897537-A1 DIRECT ELECTROCHEMISTRY OF ENZYMES BG plc (GB) 1999-02-24 EP disclosed
WO-1997043632-A1 DIRECT ELECTROCHEMISTRY OF ENZYMES BG PLC (GB) 1997-11-20 WO disclosed
WO-1990006323-A2 CHIMERIC PROTEINS INCORPORATING A METAL BINDING PROTEIN CENTOCOR, INC. (US) 1990-06-14 WO disclosed