SCHEMBL28877372

SCHEMBL28877372

CS(=O)(=O)C(c1cc(O)c(S(=O)(=O)O)cc1O)c1cc(O)c(S(=O)(=O)O)cc1O

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
HIF1A Q16665 1/20 0.37
HSD17B10 Q99714 1/20 0.37
EGFR P00533 1/20 0.33
MPL P40238 2/20 0.32
ACHE P22303 1/20 0.32
FABP3 P05413 1/20 0.32
FABP4 P15090 1/20 0.32
FABP5 Q01469 1/20 0.32
COMT P21964 1/20 0.30
PGAM1 P18669 1/20 0.30
AURKA O14965 1/20 0.30
AURKB Q96GD4 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
SCHEMBL28957909 0.88 GRM1 (0.39) LMNAHPGDHIF1AHSD17B10MPL
SCHEMBL28877429 0.82 HSD17B10 (0.40) LMNAHPGDHIF1AHSD17B10MPL
SCHEMBL13102930 0.81 FABP3 (0.46) LMNAHPGDHIF1AHSD17B10ACHE
SCHEMBL28877411 0.78 HSD17B10 (0.37) LMNAHPGDHIF1AHSD17B10MPL
Persilic Acid SCHEMBL393079 0.77 HSD17B10 (0.45) LMNAHPGDHIF1AHSD17B10EGFR
SCHEMBL28877508 0.76 LMNA (0.36) LMNAHPGDHIF1AHSD17B10MPL
Persilic Acid SCHEMBL11555522 0.75 HSD17B10 (0.44) LMNAHPGDHIF1AHSD17B10EGFR
Persilic Acid SCHEMBL6556936 0.75 HSD17B10 (0.44) LMNAHPGDHIF1AHSD17B10EGFR
Persilic Acid SCHEMBL11554176 0.75 HSD17B10 (0.44) LMNAHPGDHIF1AHSD17B10EGFR
Persilic Acid SCHEMBL6930479 0.75 HSD17B10 (0.44) LMNAHPGDHIF1AHSD17B10EGFR

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
CN-115279730-A 2, 5-or 2, 6-disubstituted hydroquinone derivatives having at least one carboxyl, sulfo or amido group useful as medicaments OM药物公司 2022-11-01 CN claimed