SCHEMBL8930398

SCHEMBL8930398

O=C(O)Cc1ccc(O)c(S(=O)(=O)O)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.61
HSD17B10 Q99714 5/20 0.61
GAA P10253 4/20 0.61
TSHR P16473 4/20 0.61
KDM4E B2RXH2 4/20 0.61
LMNA P02545 3/20 0.61
MAPT P10636 3/20 0.61
NFKB1 P19838 2/20 0.61
TDP1 Q9NUW8 2/20 0.61
HIF1A Q16665 2/20 0.61
RGS12 O14924 1/20 0.61
POLB P06746 1/20 0.61
APEX1 P27695 1/20 0.61
THPO P40225 1/20 0.61
BLM P54132 1/20 0.61
GNAI1 P63096 1/20 0.61
PMP22 Q01453 1/20 0.61
CA2 P00918 2/20 0.56
ALDH1A1 P00352 4/20 0.51
CAMK2A Q9UQM7 1/20 0.47

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
3,4-Dihydroxyphenylacetic Acid SCHEMBL21381267 0.81 GAA (0.85) HPGDHSD17B10GAATSHRKDM4E
SCHEMBL8930368 0.81 GAA (0.46) HPGDHSD17B10GAATSHRKDM4E
SCHEMBL8930341 0.81 CA2 (0.54) HPGDHSD17B10GAATSHRKDM4E
SCHEMBL8930262 0.81 POLB (0.51) HPGDHSD17B10GAATSHRKDM4E
SCHEMBL29098373 0.78 HSD17B10 (0.49) HPGDHSD17B10GAATSHRKDM4E
SCHEMBL8365925 0.77 IGF1R (0.51) HPGDHSD17B10GAAKDM4ELMNA
SCHEMBL8367570 0.77 IDH1 (0.59) HPGDHSD17B10GAALMNAHIF1A
SCHEMBL8930353 0.77 CA5A (0.67) HSD17B10GAATSHRLMNAMAPT
3,4-Dihydroxyphenylacetic Acid SCHEMBL36348 0.77 GAA (1.00) HPGDHSD17B10GAATSHRKDM4E
3,4-Dihydroxyphenylacetic Acid SCHEMBL29382155 0.77 GAA (1.00) HPGDHSD17B10GAATSHRKDM4E

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
US-5665150-A Dye and ink compositions XEROX CORPORATION (US) 1997-09-09 US disclosed