SCHEMBL7993538

SCHEMBL7993538

Cn1[nH]c(=O)n(-c2cc(F)ccc2F)c1=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
GLA P06280 1/20 0.36
TSHR P16473 3/20 0.36
HSD17B10 Q99714 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
ALOX15 P16050 2/20 0.36
MAPK14 Q16539 3/20 0.35
MAPK13 O15264 2/20 0.35
MAPK12 P53778 2/20 0.35
MAPK11 Q15759 2/20 0.35
FEN1 P39748 2/20 0.33
NOX4 Q9NPH5 2/20 0.33
HTT P42858 1/20 0.33
MPI P34949 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
SCHEMBL7979612 0.69 L3MBTL1 (0.40) L3MBTL1GLATSHRHSD17B10ALDH1A1
SCHEMBL21011975 0.68 L3MBTL1 (0.42) L3MBTL1GLATSHRHSD17B10ALDH1A1
SCHEMBL22467858 0.68 BCAT1 (0.42) L3MBTL1GLATSHRHSD17B10ALDH1A1
SCHEMBL8523910 0.67 PPOX (0.42) L3MBTL1TSHR
SCHEMBL11612676 0.67 KDM4E (0.39) L3MBTL1TSHRALDH1A1HTT
SCHEMBL7955804 0.67 L3MBTL1 (0.39) L3MBTL1GLATSHRHSD17B10ALDH1A1
SCHEMBL6829856 0.67 S1PR4 (0.37) GLATSHRNOX4HTT
SCHEMBL16325099 0.67 BCAT1 (0.31)
SCHEMBL25427552 0.65 BCAT1 (0.62) ALDH1A1
SCHEMBL5326615 0.65 GSK3A (0.55) TSHRMPI

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-2001090102-A2 6-HETEROCYCLYL-3-OXO-3,4-DIHYDRO-QUINOXALINES BAYER AKTIENGESELLSCHAFT (DE) 2001-11-29 WO disclosed