SCHEMBL4180273

SCHEMBL4180273

CCOC(=O)[C@H](CCC(N)=O)NC(=O)CC

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.61
KMT2A Q03164 2/20 0.58
POLB P06746 1/20 0.58
NOD1 Q9Y239 4/20 0.46
CAD P27708 1/20 0.45
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
BMP1 P13497 1/20 0.39
ALOX15 P16050 1/20 0.36
PPID Q08752 1/20 0.35
CYP2C9 P11712 2/20 0.35
P2RY12 Q9H244 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.35
FOLH1 Q04609 1/20 0.35

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
SCHEMBL4180270 1.00 L3MBTL1 (0.61) L3MBTL1KMT2APOLBNOD1CAD
SCHEMBL7608495 0.86 L3MBTL1 (0.56) L3MBTL1KMT2APOLBNOD1CAD
SCHEMBL27489411 0.85 L3MBTL1 (0.44) L3MBTL1KMT2APOLBNOD1BMP1
SCHEMBL4189292 0.85 L3MBTL1 (0.84) L3MBTL1KMT2APOLBNOD1CAD
SCHEMBL468757 0.85 L3MBTL1 (0.54) L3MBTL1KMT2APOLBNOD1CAD
SCHEMBL4189297 0.85 L3MBTL1 (0.84) L3MBTL1KMT2APOLBNOD1CAD
SCHEMBL468758 0.85 L3MBTL1 (0.54) L3MBTL1KMT2APOLBNOD1CAD
SCHEMBL28329549 0.84 KMT2A (0.68) L3MBTL1KMT2APOLBNOD1
SCHEMBL3773213 0.83 KMT2A (0.69) L3MBTL1KMT2APOLBNOD1
SCHEMBL3776147 0.83 KMT2A (0.69) L3MBTL1KMT2APOLBNOD1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1865953-A4 COMPOSITION COMPRISING N-PROPANOYL DERIVATIVES OF AMINO ACIDS, AMINOCARBOHYDRATES AND DERIVATIVES THEREOF YU RUEY J (US) 2008-04-30 EP claimed
EP-1865953-A2 COMPOSITION COMPRISING N-PROPANOYL DERIVATIVES OF AMINO ACIDS, AMINOCARBOHYDRATES AND DERIVATIVES THEREOF Yu, Ruey J., Dr. (US) 2007-12-19 EP claimed
WO-2006101940-A2 COMPOSITION COMPRISING N-PROPANOYL DERIVATIVES OF AMINO ACIDS, AMINOCARBOHYDRATES AND DERIVATIVES THEREOF YU, RUEY, J. (US) 2006-09-28 WO claimed
US-20060211754-A1 Compositions comprising N-propanoyl derivatives of amino acids, aminocarbohydrates and derivatives thereof YU RUEY J 2006-09-21 US claimed
US-20090186853-A1 COMPOSITIONS COMPRISING N-PROPANOYL DERIVATIVES OF AMINO ACIDS, AMINOCARBOHYDRATES AND DERIVATIVES THEREOF YU RUEY J 2009-07-23 US disclosed
EP-1865953-A4 COMPOSITION COMPRISING N-PROPANOYL DERIVATIVES OF AMINO ACIDS, AMINOCARBOHYDRATES AND DERIVATIVES THEREOF YU RUEY J (US) 2008-04-30 EP disclosed
EP-1865953-A2 COMPOSITION COMPRISING N-PROPANOYL DERIVATIVES OF AMINO ACIDS, AMINOCARBOHYDRATES AND DERIVATIVES THEREOF Yu, Ruey J., Dr. (US) 2007-12-19 EP disclosed
WO-2006101940-A2 COMPOSITION COMPRISING N-PROPANOYL DERIVATIVES OF AMINO ACIDS, AMINOCARBOHYDRATES AND DERIVATIVES THEREOF YU, RUEY, J. (US) 2006-09-28 WO disclosed
US-20060211754-A1 Compositions comprising N-propanoyl derivatives of amino acids, aminocarbohydrates and derivatives thereof YU RUEY J 2006-09-21 US disclosed