SCHEMBL9818573

SCHEMBL9818573

O=S(=O)(O)c1cc(O)c(S(=O)(=O)O)c(O)c1S(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPL P40238 6/20 0.38
HSD17B10 Q99714 3/20 0.36
ALDH1A1 P00352 2/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP2D6 P10635 1/20 0.36
NQO1 P15559 1/20 0.35
ING2 Q9H160 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
HIF1A Q16665 1/20 0.34
PGAM1 P18669 1/20 0.34
CTRC Q99895 2/20 0.33
NSD2 O96028 1/20 0.33
MMP14 P50281 1/20 0.33
CASP6 P55212 1/20 0.33
NT5E P21589 1/20 0.33
FABP3 P05413 1/20 0.32
FABP4 P15090 1/20 0.32

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
SCHEMBL1890371 0.86 MPL (0.38) MPLHSD17B10ALDH1A1CASP1CASP7
SCHEMBL29373733 0.86 MPL (0.38) MPLHSD17B10ALDH1A1CASP1CASP7
SCHEMBL16950300 0.86 PGAM1 (0.42) MPLHSD17B10ALDH1A1CASP1CASP7
SCHEMBL7095349 0.85 ING2 (0.39) MPLHSD17B10ALDH1A1CASP1CASP7
SCHEMBL30603174 0.84 MPL (0.37) MPLHSD17B10ALDH1A1CASP1CASP7
SCHEMBL11772949 0.82 HSD17B10 (0.40) MPLHSD17B10ALDH1A1CASP1CASP7
SCHEMBL8746545 0.82 MPL (0.38) MPLHSD17B10ALDH1A1CASP1CASP7
SCHEMBL10524088 0.80 MPL (0.37) MPLHSD17B10ALDH1A1CASP1CASP7
SCHEMBL10524101 0.80 ING2 (0.38) MPLHSD17B10ALDH1A1CASP1CASP7
SCHEMBL17023239 0.79 PGAM1 (0.38) MPLHSD17B10ALDH1A1CASP1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8524646-B2 Multi-compartment pouch THE PROCTER & GAMBLE COMPANY (US) 2013-09-03 US disclosed
EP-0146923-B1 PREPARATION OF HALOGENATED PHENOLS FIDIA S.p.A. (IT) 1991-07-10 EP disclosed
US-4704469-A Preparation of halogenated phenols FIDIA S.P.A. (IT) 1987-11-03 US disclosed
EP-0146923-A1 Preparation of halogenated phenols FIDIA S.p.A. (IT) 1985-07-03 EP disclosed