SCHEMBL5262474

SCHEMBL5262474

CC[C@@H](CC(C)C)NC(=O)OC(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.53
▸ CA2 P00918 1/20 0.53
▸ CA7 P43166 1/20 0.53
▸ CTSK P43235 4/20 0.50
▸ CTSS P25774 3/20 0.50
▸ CTSL P07711 2/20 0.50
▸ CTSB P07858 1/20 0.50
▸ CAPN1 P07384 1/20 0.50
▸ AAK1 Q2M2I8 4/20 0.49
▸ CYP2D6 P10635 1/20 0.44
▸ SYK P43405 1/20 0.44

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
SCHEMBL21169229 1.00 CA1 (0.53) CA1CA2CA7CTSKCTSS
SCHEMBL15250454 1.00 CA1 (0.53) CA1CA2CA7CTSKCTSS
SCHEMBL19227630 0.91 CA1 (0.58) CA1CA2CA7CTSKCTSS
SCHEMBL12336373 0.88 CA1 (0.47) CA1CA2CA7CTSKCTSS
SCHEMBL16591738 0.88 CA1 (0.47) CA1CA2CA7CTSKCTSS
SCHEMBL9911449 0.87 CA1 (0.52) CA1CA2CA7CTSKCTSS
SCHEMBL4032796 0.86 CA1 (0.53) CA1CA2CA7CTSKCTSS
SCHEMBL8560322 0.86 CA1 (0.53) CA1CA2CA7CTSKCTSS
SCHEMBL272780 0.86 CA1 (0.53) CA1CA2CA7CTSKCTSS
SCHEMBL8561571 0.86 CA1 (0.53) CA1CA2CA7CTSKCTSS

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-1836161-A2 METHODS AND COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES Neurochem (International) Limited (CH) 2007-09-26 — — EP disclosed
WO-2006085149-A2 METHODS AND COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2006-08-17 — — WO disclosed
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