SCHEMBL3884537

SCHEMBL3884537

CC(C)(C)OC(=O)N(N)C(=O)CCC(=O)N(N)C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
CA14 Q9ULX7 3/20 0.33
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA7 P43166 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
CA2 P00918 1/20 0.33
DGAT1 O75907 1/20 0.31

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
SCHEMBL3884535 0.92 HDAC6 (0.40) HDAC6HDAC1HDAC2CA14CA12
SCHEMBL5555258 0.90 HDAC6 (0.57) HDAC6HDAC1HDAC2CA14CA12
SCHEMBL8806268 0.87 HDAC6 (0.41) HDAC6HDAC1HDAC2CA14CA12
SCHEMBL4676227 0.87 HDAC6 (0.46) HDAC6HDAC1HDAC2CA14NFKB1
SCHEMBL27765894 0.87 HDAC6 (0.46) HDAC6HDAC1HDAC2CA14CA12
SCHEMBL5943153 0.84 HDAC6 (0.51) HDAC6HDAC1HDAC2CA14NFKB1
SCHEMBL8896065 0.84 HDAC6 (0.51) HDAC6HDAC1HDAC2CA14NFKB1
SCHEMBL1706932 0.84 HDAC6 (0.38) HDAC6HDAC1HDAC2CA14CA12
SCHEMBL5580137 0.83 AKT1 (0.39) HDAC6HDAC1HDAC2CA14CA12
SCHEMBL1401436 0.83 AKT1 (0.39) HDAC6HDAC1HDAC2CA14CA12

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
EP-1183049-B1 MODIFICATION OF BIOLOGICAL ELEMENTS HYBRID SYSTEMS LTD (GB) 2009-01-14 EP disclosed
US-7279318-B1 Modification of biological elements HYBRID SYSTEMS LIMITED (GB) 2007-10-09 US disclosed
EP-0941123-B1 NUCLEIC ACID COMPLEXED WITH CATIONIC POLYMER USEFUL FOR GENE THERAPY HYBRID SYSTEMS LTD (GB) 2002-06-12 EP disclosed
EP-1183049-A2 MODIFICATION OF BIOLOGICAL ELEMENTS Hybrid Systems Limited (GB) 2002-03-06 EP disclosed
US-6312727-B1 SYNTHETIC POLYMER CARRIER VEHICLE FOR DELIVERY OF NUCLEIC ACID TO TARGET CELLS IN BIOLOGICAL SYSTEMS HYBRID SYSTEMS LIMITED (GB) 2001-11-06 US disclosed
WO-2000074722-A2 MODIFICATION OF BIOLOGICAL ELEMENTS HYBRID SYSTEMS LIMITED (GB) 2000-12-14 WO disclosed
EP-0941123-A2 DELIVERY OF NUCLEIC ACID MATERIAL TO TARGET CELLS IN BIOLOGICAL SYSTEMS SCHACHT, Etienne Honoré (BE) 1999-09-15 EP disclosed
WO-1998019710-A2 DELIVERY OF NUCLEIC ACID MATERIAL TO TARGET CELLS IN BIOLOGICAL SYSTEMS SCHACHT ETIENNE HONORE (BE) 1998-05-14 WO disclosed