SCHEMBL8901016

SCHEMBL8901016

CC(=O)N(C(=O)c1ccccc1)c1ccccc1S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.41
GAA P10253 1/20 0.40
POLB P06746 1/20 0.36
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTR6 P50406 1/20 0.36
NR3C2 P08235 1/20 0.35
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
HPGD P15428 1/20 0.35
MYC P01106 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP1A2 P05177 1/20 0.35
TTR P02766 1/20 0.33

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
SCHEMBL10538919 0.83 GAA (0.50) HSD11B1GAAPOLBALDH1A1MAPT
SCHEMBL8356461 0.77 LMNA (0.45) HSD11B1GAAPOLBKMT2AALDH1A1
SCHEMBL7051694 0.73 HTR6 (0.40) GAAKMT2AALDH1A1MAPTHTR6
SCHEMBL27258081 0.72 RAB9A (0.47) HSD11B1KMT2AALDH1A1NR3C2CES2
SCHEMBL9172146 0.72 NPSR1 (0.44) HSD11B1GAAPOLBKMT2AALDH1A1
SCHEMBL6265807 0.70 HTR6 (0.60) GAAKMT2AALDH1A1LMNAMAPT
SCHEMBL28326313 0.69 HTR6 (0.58) GAAKMT2AALDH1A1LMNAMAPT
SCHEMBL8916208 0.68 HTR6 (0.44) GAAKMT2AALDH1A1MAPTHTR6
SCHEMBL8621263 0.68 AKR1C3 (0.52) GAAPOLBKMT2AALDH1A1MAPT
SCHEMBL4600284 0.68 EGFR (0.39) GAAPOLBKMT2AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0797774-A1 MULTILAYER ANALYTICAL ELEMENT 2860601 Canada Inc. (CN) 1997-10-01 EP claimed
WO-1996018898-A1 MULTILAYER ANALYTICAL ELEMENT 2860601 CANADA INC. (CA) 1996-06-20 WO claimed