SCHEMBL27606643

SCHEMBL27606643

CC(C)(C)OC(=O)N(CC(=O)O)C(=O)CNC(=O)CN

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
CA14 Q9ULX7 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC6 Q9UBN7 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
SCHEMBL7633350 0.85 GLRA1 (0.32)
SCHEMBL2435231 0.85 HDAC6 (0.37) MEN1GAAKMT2ACA14HDAC1
SCHEMBL27659749 0.81 MEN1 (0.43) MEN1GAAKMT2ACA14
SCHEMBL6841493 0.79 GLRA1 (0.30)
SCHEMBL7248146 0.78 MEN1 (0.38) MEN1GAAKMT2ACA14HDAC1
SCHEMBL2819946 0.77 TERT (0.31)
SCHEMBL7719558 0.76 HDAC6 (0.38) MEN1GAAKMT2ACA14HDAC1
SCHEMBL7872934 0.74
SCHEMBL468872 0.73 PAOX (0.32)
SCHEMBL15090435 0.72 PSMB5 (0.31) GAA

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
CN-100372570-C Pharmaceutical compositions comprising polysaccharide conjugates for inhibiting the metastsis or preventing the recurrence of maligant tumor TANABE SEIYAKU CO (JP) 2008-03-05 CN disclosed
CN-1545423-A Pharmaceutical compositions comprising polysaccharide conjugates for inhibiting the metastsis or preventing the recurrence of maligant tumor ������ҩ��ʽ���� 2004-11-10 CN disclosed