SCHEMBL1925237

SCHEMBL1925237

CN(CC(=O)ON)C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
CTSD P07339 1/20 0.32
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
CTSS P25774 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.31
CACNA1G O43497 1/20 0.31
CACNA1B Q00975 1/20 0.31
CACNA1C Q13936 1/20 0.31
AAK1 Q2M2I8 1/20 0.31
GBA1 P04062 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
SCHEMBL1689401 0.86 HDAC6 (0.37) HDAC6HDAC1HDAC2CTSDCTSL
SCHEMBL3187773 0.84 HDAC6 (0.36) HDAC6HDAC1HDAC2CTSDCTSL
SCHEMBL7023795 0.82 CA14 (0.39) HDAC6HDAC1HDAC2CTSDCTSL
SCHEMBL14789144 0.82 HDAC6 (0.35) HDAC6HDAC1HDAC2CTSDCTSL
SCHEMBL1926409 0.80 HDAC6 (0.36) HDAC6HDAC1HDAC2CTSDCTSL
SCHEMBL14311330 0.79 CA12 (0.38) HDAC6HDAC1HDAC2CTSDCTSL
SCHEMBL5001089 0.79 CA12 (0.55) HDAC6HDAC1HDAC2CA12CA1
SCHEMBL1949583 0.79 CA12 (0.34) HDAC6HDAC1HDAC2CTSLCTSB
SCHEMBL15487077 0.78 CA12 (0.37) HDAC6HDAC1HDAC2CTSDCTSL
SCHEMBL992004 0.78 CA12 (0.37) HDAC6HDAC1HDAC2CTSDCTSL

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-2011071951-A2 N-ACYLOXYSULFONAMIDE AND N-HYDROXY-N-ACYLSULFONAMIDE DERIVATIVES JOHNS HOPKINS UNIVERSITY (US) 2011-06-16 WO disclosed