SCHEMBL6676068

SCHEMBL6676068

CCOC(=O)C(CS)NC(=O)CCNC(C)=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
POLB P06746 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.45
ACACB O00763 1/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 2/20 0.39
THRB P10828 1/20 0.39
ALOX15 P16050 1/20 0.39
NFKB1 P19838 1/20 0.39
PTGS2 P35354 1/20 0.39
THPO P40225 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39
NOD1 Q9Y239 3/20 0.36
CAD P27708 1/20 0.36
ALDH1A1 P00352 1/20 0.34
PTGS1 P23219 1/20 0.33
GSTK1 Q9Y2Q3 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL2140677 0.82 KMT2A (0.53) KMT2APOLBL3MBTL1MAPTSMN1; SMN2
SCHEMBL4727586 0.80 MAPT (0.59) KMT2APOLBL3MBTL1MAPTSMN1; SMN2
SCHEMBL122644 0.80 MAPT (0.59) KMT2APOLBL3MBTL1MAPTSMN1; SMN2
SCHEMBL122645 0.80 MAPT (0.59) KMT2APOLBL3MBTL1MAPTSMN1; SMN2
SCHEMBL5058848 0.80 L3MBTL1 (0.61) KMT2APOLBL3MBTL1MAPTSMN1; SMN2
SCHEMBL5020127 0.79 L3MBTL1 (0.50) KMT2APOLBL3MBTL1MAPTSMN1; SMN2
SCHEMBL1217960 0.76 NOD1 (0.55) KMT2APOLBL3MBTL1NOD1CAD
SCHEMBL1217963 0.76 NOD1 (0.55) KMT2APOLBL3MBTL1NOD1CAD
SCHEMBL29543223 0.76 L3MBTL1 (0.47) KMT2APOLBL3MBTL1ACACBMAPT
SCHEMBL5020129 0.75 L3MBTL1 (0.44) KMT2APOLBL3MBTL1MAPTSMN1; SMN2

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-2004037159-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR MODULATING FAT METABOLISM OBETHERAPY BIOTECHNOLOGY (FR) 2004-05-06 WO disclosed