SCHEMBL19199477

SCHEMBL19199477

O=S(=O)(O)c1cc(I)cc(O)c1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.39
ALDH1A1 P00352 2/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NQO1 P15559 1/20 0.38
TTR P02766 1/20 0.37
PGAM1 P18669 1/20 0.37
TET2 Q6N021 1/20 0.37
NSD2 O96028 1/20 0.35
MMP14 P50281 1/20 0.35
CASP6 P55212 1/20 0.35
MPL P40238 3/20 0.34
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
HIF1A Q16665 1/20 0.33
ING2 Q9H160 1/20 0.33
ERN1 O75460 1/20 0.32
ACP1 P24666 1/20 0.32
GABRA1 P14867 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
SCHEMBL669532 0.77 NSD2 (0.44) HSD17B10ALDH1A1CASP1CASP7TDP1
SCHEMBL30999 0.76 ING2 (0.48) HSD17B10ALDH1A1CASP1CASP7TDP1
SCHEMBL9242875 0.76 ING2 (0.48) HSD17B10ALDH1A1CASP1CASP7TDP1
SCHEMBL29367149 0.76 ING2 (0.48) HSD17B10ALDH1A1CASP1CASP7TDP1
SCHEMBL772208 0.76 ING2 (0.48) HSD17B10ALDH1A1CASP1CASP7TDP1
SCHEMBL30057851 0.76 ING2 (0.48) HSD17B10ALDH1A1CASP1CASP7TDP1
SCHEMBL9950364 0.75 TET2 (0.36) HSD17B10ALDH1A1CASP1CASP7TDP1
SCHEMBL19199533 0.75 TTR (0.36) HSD17B10ALDH1A1TTRLMNAHPGD
SCHEMBL669090 0.75 PGAM1 (0.48) HSD17B10ALDH1A1CASP1CASP7TDP1
Water SCHEMBL7784437 0.74 ING2 (0.47) HSD17B10ALDH1A1CASP1CASP7TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017218499-A1 IONIC POLYMERS AND THEIR USE AS WET-ADHESIVES AND COATINGS ACatechol, Inc. (US) 2017-12-21 WO disclosed
WO-2017132484-A1 PHOTO-CLEAVABLE PRIMER COMPOSITIONS AND METHODS OF USE ACatechol, Inc. (US) 2017-08-03 WO disclosed