SCHEMBL3263217

SCHEMBL3263217

CC(C)C(=O)C1CC(=O)NC1=O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 1/20 0.43
CRBN Q96SW2 4/20 0.37
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 2/20 0.33
MEN1 O00255 1/20 0.33
APEX1 P27695 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GLA P06280 1/20 0.33
DDB1 Q16531 3/20 0.32
TSHR P16473 1/20 0.32
ALOX15 P16050 1/20 0.31
LMNA P02545 1/20 0.31
CYP19A1 P11511 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
SCHEMBL28384946 0.79 MAP3K14 (0.35) MAP3K14CRBNALDH1A1TDP1MEN1
SCHEMBL6511682 0.77 MAP3K14 (0.43) MAP3K14CRBNALDH1A1TDP1MEN1
SCHEMBL21658858 0.76 MAP3K14 (0.46) MAP3K14CRBNALDH1A1TDP1MEN1
SCHEMBL11130524 0.74 MAP3K14 (0.34) MAP3K14ALDH1A1TDP1MEN1APEX1
SCHEMBL11130527 0.74 MAP3K14 (0.34) MAP3K14ALDH1A1TDP1MEN1APEX1
SCHEMBL2711511 0.74 MAP3K14 (0.44) MAP3K14CRBNALDH1A1TDP1MEN1
SCHEMBL514603 0.74 ALDH1A1 (0.52) MAP3K14CRBNALDH1A1TDP1MEN1
SCHEMBL28499087 0.73 EPHX2 (0.39) KMT2AGLA
SCHEMBL2896147 0.72 MEN1 (0.47) MAP3K14CRBNALDH1A1TDP1MEN1
SCHEMBL1530916 0.72 CRBN (0.41) MAP3K14CRBNALDH1A1TDP1MEN1

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
EP-1712601-B1 Phase change inks XEROX CORP (US) 2010-07-28 EP disclosed