SCHEMBL28786000

SCHEMBL28786000

[CH2]CCC(c1ccccc1)N1C(=O)C=CC1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.38
GSK3A P49840 3/20 0.38
GSK3B P49841 3/20 0.38
SLC6A2 P23975 6/20 0.37
SLC6A4 P31645 4/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
FAAH O00519 1/20 0.33
HSP90AA1 P07900 1/20 0.32
HPGD P15428 1/20 0.32
XBP1 P17861 1/20 0.32
ALOX12 P18054 1/20 0.32
HTT P42858 1/20 0.32
RUNX1 Q01196 1/20 0.32
ATM Q13315 1/20 0.32
CBFB Q13951 1/20 0.32
TLR9 Q9NR96 1/20 0.32

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
SCHEMBL1608836 0.79 ALDH1A1 (0.46) MGLLGSK3AGSK3BMEN1KMT2A
SCHEMBL28286235 0.78 LMNA (0.41) MGLLGSK3AGSK3BSLC6A2SLC6A4
SCHEMBL9562580 0.76 MGLL (0.46) MGLLGSK3AGSK3BMEN1KMT2A
SCHEMBL10973243 0.75 KMT2A (0.47) MEN1KMT2AALDH1A1HSD17B10L3MBTL1
SCHEMBL19994458 0.73 LMNA (0.45) SLC6A2SLC6A4KMT2AL3MBTL1
SCHEMBL28784804 0.71 MGLL (0.41) MGLLGSK3AGSK3BALDH1A1FAAH
SCHEMBL384411 0.70 MGLL (0.44) MGLLGSK3AGSK3BALDH1A1FAAH
SCHEMBL2175411 0.70 MGLL (0.44) MGLLGSK3AGSK3BMEN1KMT2A
SCHEMBL721638 0.70 KMT2A (0.37) MGLLMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL8871478 0.69 ALDH1A1 (0.41) KMT2AALDH1A1HSD17B10L3MBTL1

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
CN-1450394-B Optical alignment method and liquid crystal display element JSR CORP 2010-04-28 CN disclosed