SCHEMBL8930262

SCHEMBL8930262

Cc1ccc(CC(=O)O)cc1S(=O)(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
RECQL P46063 1/20 0.51
ESR2 Q92731 1/20 0.51
CA5A P35218 1/20 0.48
KDM4E B2RXH2 4/20 0.46
HPGD P15428 4/20 0.46
HSD17B10 Q99714 4/20 0.46
MAPT P10636 3/20 0.46
GAA P10253 3/20 0.46
TSHR P16473 3/20 0.46
NFKB1 P19838 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
RGS12 O14924 1/20 0.46
LMNA P02545 1/20 0.46
APEX1 P27695 1/20 0.46
THPO P40225 1/20 0.46
BLM P54132 1/20 0.46
GNAI1 P63096 1/20 0.46
PMP22 Q01453 1/20 0.46
HIF1A Q16665 1/20 0.46

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
SCHEMBL13917723 0.82 ESR2 (0.69) POLBRECQLESR2KDM4EHPGD
SCHEMBL8930398 0.81 HPGD (0.61) POLBCA5AKDM4EHPGDHSD17B10
SCHEMBL1309212 0.80 POLB (0.55) POLBRECQLESR2HPGDHSD17B10
SCHEMBL1805731 0.80 POLB (0.55) POLBRECQLESR2HPGDHSD17B10
SCHEMBL1803016 0.80 POLB (0.55) POLBRECQLESR2HPGDHSD17B10
SCHEMBL1805735 0.80 POLB (0.55) POLBRECQLESR2CA5AHPGD
SCHEMBL8930341 0.79 CA2 (0.54) POLBCA5AKDM4EHPGDHSD17B10
SCHEMBL8930368 0.79 GAA (0.46) POLBCA5AKDM4EHPGDHSD17B10
SCHEMBL8930353 0.79 CA5A (0.67) CA5AHSD17B10MAPTGAATSHR
SCHEMBL1803020 0.79 POLB (0.54) POLBRECQLESR2CA5AKDM4E

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