SCHEMBL19199331

SCHEMBL19199331

O=S(=O)(O)c1c(O)cc(I)c(O)c1O

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.37
ING2 Q9H160 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
ERN1 O75460 1/20 0.32
CYP2D6 P10635 1/20 0.32
FABP3 P05413 1/20 0.31
FABP4 P15090 1/20 0.31
FABP5 Q01469 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ALB P02768 1/20 0.31
APP P05067 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 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
SCHEMBL19199478 0.83 TTR (0.37) TTRING2MEN1LMNAHTT
SCHEMBL19199479 0.83 ING2 (0.33) TTRING2CYP2D6FABP3FABP4
SCHEMBL668351 0.79 ING2 (0.37) TTRING2MEN1LMNAKMT2A
SCHEMBL7095349 0.79 ING2 (0.39) TTRING2MEN1LMNAKMT2A
SCHEMBL16950300 0.76 PGAM1 (0.42) ING2LMNACYP2D6FABP3FABP4
SCHEMBL19199533 0.75 TTR (0.36) TTRING2LMNAERN1CYP2D6
SCHEMBL19199363 0.74 HSD17B10 (0.35) LMNACYP2D6ALDH1A1HSD17B10
SCHEMBL19194198 0.74 MAPT (0.47) ING2MEN1LMNAHTTKMT2A
SCHEMBL9818573 0.71 MPL (0.38) ING2LMNACYP2D6FABP3FABP4
SCHEMBL19730666 0.71 PGAM1 (0.46) TTRING2MEN1LMNAHTT

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