SCHEMBL905269

SCHEMBL905269

Cc1cn(CC(=O)NCC(=O)O)c(=O)[nH]c1=O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
KMT2A Q03164 1/20 0.49
HPGD P15428 1/20 0.48
TK1 P04183 4/20 0.46
MAPK1 P28482 1/20 0.46
TYMP P19971 1/20 0.43
TK2 O00142 1/20 0.42

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
SCHEMBL14255480 0.85 KMT2A (0.51) LMNAKMT2AHPGDTK1MAPK1
SCHEMBL6167702 0.85 KMT2A (0.51) LMNAKMT2AHPGDTK1MAPK1
SCHEMBL456749 0.83 HPGD (0.57) HPGDTK1MAPK1TYMPTK2
SCHEMBL23328752 0.82 MAPK1 (0.50) LMNAKMT2AHPGDTK1MAPK1
SCHEMBL5962125 0.81 KMT2A (0.45) LMNAKMT2AHPGDTK1MAPK1
Ethylene Glycol SCHEMBL9298238 0.79 HPGD (0.53) HPGDTK1MAPK1TYMPTK2
SCHEMBL23329069 0.79 TK1 (0.53) LMNAKMT2ATK1
SCHEMBL23328870 0.78 TYMP (0.48) LMNAKMT2AHPGDTK1MAPK1
SCHEMBL23328426 0.78 MAPK1 (0.47) LMNAKMT2AHPGDTK1MAPK1
SCHEMBL17013819 0.78 MAPK1 (0.56) HPGDTK1MAPK1TYMP

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-1748078-B1 Methods, kits and compositions of combination oligomers BOSTON PROBES INC (US) 2011-01-19 EP disclosed
EP-1651642-B1 PNA MONOMER AND PRECURSOR PANAGENE INC (KR) 2009-11-04 EP disclosed