SCHEMBL19199533

SCHEMBL19199533

O=S(=O)(O)c1c(O)cc(I)cc1O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.36
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 2/20 0.34
FABP3 P05413 1/20 0.34
FABP4 P15090 1/20 0.34
FABP5 Q01469 1/20 0.34
ACP1 P24666 1/20 0.34
ING2 Q9H160 1/20 0.32
LMNA P02545 1/20 0.32
NT5E P21589 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
ERN1 O75460 2/20 0.31
CYP2D6 P10635 1/20 0.31
GABRA1 P14867 1/20 0.30
GABRB1 P18505 1/20 0.30
GABRB2 P47870 1/20 0.30

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
SCHEMBL668197 0.79 NQO1 (0.42) ALDH1A1HSD17B10FABP3FABP4FABP5
SCHEMBL3139616 0.77 TTR (0.43) TTRFABP3FABP4FABP5ACP1
SCHEMBL27966425 0.77 ALDH1A1 (0.50) ALDH1A1HSD17B10ING2LMNANT5E
SCHEMBL10533596 0.75 SELL (0.48) ALDH1A1HSD17B10FABP3FABP4FABP5
SCHEMBL19199331 0.75 TTR (0.37) TTRALDH1A1HSD17B10FABP3FABP4
SCHEMBL19199477 0.75 HSD17B10 (0.39) TTRALDH1A1HSD17B10ACP1ING2
SCHEMBL7095349 0.74 ING2 (0.39) TTRALDH1A1HSD17B10FABP3FABP4
SCHEMBL17810257 0.73 RAPGEF4 (0.42) TTRFABP3FABP4FABP5ACP1
SCHEMBL668351 0.70 ING2 (0.37) TTRALDH1A1HSD17B10FABP3FABP4
SCHEMBL28020177 0.70 ING2 (0.37) TTRALDH1A1HSD17B10FABP3FABP4

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-2017132484-A1 PHOTO-CLEAVABLE PRIMER COMPOSITIONS AND METHODS OF USE ACatechol, Inc. (US) 2017-08-03 WO disclosed