SCHEMBL6058801

SCHEMBL6058801

Cc1cc(CO[Si](C)(C)C(C)(C)C)cnc1N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.35
USP30 Q70CQ3 1/20 0.32
MKNK2 Q9HBH9 1/20 0.31
BACE1 P56817 1/20 0.30

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
SCHEMBL6059794 0.82 LCK (0.36) PDPK1USP30MKNK2
SCHEMBL6058759 0.81 PDPK1 (0.35) PDPK1USP30MKNK2
SCHEMBL6059049 0.81 USP30 (0.33) PDPK1USP30BACE1
SCHEMBL18359637 0.76 PDPK1 (0.36) PDPK1USP30MKNK2
SCHEMBL6058738 0.76 PDPK1 (0.35) PDPK1USP30BACE1
SCHEMBL6059056 0.75 PDPK1 (0.34) PDPK1USP30MKNK2
SCHEMBL6058840 0.74 USP30 (0.34) PDPK1USP30MKNK2BACE1
SCHEMBL31268069 0.74 AAK1 (0.46) PDPK1USP30MKNK2BACE1
SCHEMBL30463735 0.74 PDPK1 (0.35) PDPK1USP30MKNK2
SCHEMBL30463733 0.74 PDPK1 (0.35) PDPK1USP30MKNK2

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
US-7071175-B1 Pyridine mercapto carboxylic acids as carboxypeptidase U inhibitors ASTRAZENECA AB (SE) 2006-07-04 US disclosed
EP-1180098-A1 NEW COMPOUNDS AstraZeneca AB (SE) 2002-02-20 EP disclosed
WO-2000066557-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 2000-11-09 WO disclosed