SCHEMBL5517399

SCHEMBL5517399

C=CC(=O)OC(CC)Oc1ccccc1OC(=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.48
MEN1 O00255 3/20 0.48
CYP3A4 P08684 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MAPT P10636 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
SLC6A3 Q01959 1/20 0.42
SRD5A1 P18405 1/20 0.39
THRB P10828 2/20 0.39
THRA P10827 1/20 0.39
SERPINE1 P05121 1/20 0.38
JAK2 O60674 1/20 0.38
USP2 O75604 1/20 0.38
ESR1 P03372 1/20 0.38
GAA P10253 1/20 0.38
ALOX15 P16050 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ESR2 Q92731 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL5530462 0.90 KMT2A (0.44) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL9650729 0.83 TSHR (0.45) KMT2AMEN1TDP1MAPTSMN1; SMN2
SCHEMBL28135705 0.82 ABCB1 (0.46) KMT2AMEN1MAPTNPSR1ALDH1A1
SCHEMBL181485 0.80 THRB (0.40) CYP3A4TDP1L3MBTL1MAPTTHRB
SCHEMBL23581926 0.80 HTT (0.43) KMT2AMEN1TDP1L3MBTL1MAPT
SCHEMBL10869832 0.79 LMNA (0.43) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL218320 0.78 THRB (0.46) KMT2AMEN1CYP3A4MAPTSMN1; SMN2
SCHEMBL6567885 0.78 KMT2A (0.58) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL28024159 0.76 MAPT (0.52) KMT2AMEN1CYP3A4TDP1MAPT
SCHEMBL21383342 0.76 HTT (0.38) KMT2AMEN1TDP1L3MBTL1MAPT

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-2007083848-A1 COMPOSITION, RETARDATION PLATE, LIQUID-CRYSTAL DISPLAY DEVICE, AND METHOD FOR PRODUCING RETARDATION PLATE FUJIFILM CORPORATION (JP) 2007-07-26 WO disclosed