SCHEMBL6829518

SCHEMBL6829518

CCN(CC(O)CS(=O)(=O)O)c1cccc(OC)c1OC

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.38
HTT P42858 3/20 0.37
TSHR P16473 1/20 0.37
LMNA P02545 2/20 0.37
POLB P06746 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 3/20 0.36
GAA P10253 2/20 0.36
AOC3 Q16853 1/20 0.35
MAPT P10636 3/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA14 Q9ULX7 1/20 0.34
MEN1 O00255 2/20 0.34
NFE2L2 Q16236 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL6130324 0.99 ESR1 (0.38) ESR1HTTTSHRLMNAPOLB
SCHEMBL6130322 0.88 ESR1 (0.39) ESR1HTTTSHRLMNAPOLB
SCHEMBL11823240 0.79 HTR1A (0.40) AOC3SMN1; SMN2
SCHEMBL6253134 0.77 PER2 (0.41) ESR1HTTTSHRLMNAHPGD
SCHEMBL8650210 0.74 LMNA (0.44) ESR1HTTLMNAPOLBHPGD
SCHEMBL242597 0.74 ESR1 (0.47) ESR1HTTLMNAKMT2AAOC3
SCHEMBL6480203 0.73 LMNA (0.46) ESR1HTTLMNAPOLBHPGD
SCHEMBL27434036 0.73 LMNA (0.39) LMNAPOLBMAPTALDH1A1KDM4E
SCHEMBL9879559 0.73 ESR1 (0.46) ESR1HTTLMNAKMT2AAOC3
SCHEMBL17685583 0.73 ESR1 (0.49) ESR1HTTLMNAKMT2AAOC3

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
WO-2004108686-A2 BENZIMIDAZOLE COMPOUNDS HAVING HYPOGLYCEMIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-16 WO disclosed