SCHEMBL7752008

SCHEMBL7752008

O=C(c1ccccc1)c1ccc(OS(=O)(=O)CF)c(OS(=O)(=O)CF)c1OS(=O)(=O)CF

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.41
MAPK1 P28482 3/20 0.41
KDM4E B2RXH2 3/20 0.41
HSD17B10 Q99714 2/20 0.41
ALOX15 P16050 1/20 0.41
LMNA P02545 4/20 0.39
HTT P42858 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.37
STS P08842 2/20 0.37
AKR1C3 P42330 1/20 0.37
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 3/20 0.36
GAA P10253 2/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
HPGD P15428 2/20 0.35

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
SCHEMBL929635 0.84 MAPT (0.43) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL926997 0.79 MAPT (0.42) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL8433674 0.78 MAPT (0.48) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL926963 0.75 MAPT (0.42) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL927427 0.72 ENPP3 (0.42) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL3803930 0.72 KMT2A (0.40) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL927093 0.72 ALPL (0.47) MAPTMAPK1LMNAHTTSMN1; SMN2
SCHEMBL7537325 0.70 MAPT (0.41) MAPTMAPK1SMN1; SMN2STSKEAP1
SCHEMBL7889107 0.69 STS (0.43) MAPTMAPK1KDM4EALOX15HTT
SCHEMBL13254618 0.69 MAPT (0.50) MAPTMAPK1KDM4EHSD17B10ALOX15

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0864119-B1 PHOTOSENSITIVE COMPOSITION ATOTECH DEUTSCHLAND GMBH (DE) 2001-02-14 EP disclosed
EP-0864119-A1 PHOTOSENSITIVE COMPOSITION ATOTECH Deutschland GmbH (DE) 1998-09-16 EP disclosed
WO-1997020254-A1 PHOTOSENSITIVE COMPOSITION ATOTECH DEUTSCHLAND GMBH (DE) 1997-06-05 WO disclosed