SCHEMBL5157835

SCHEMBL5157835

CS(=O)(=O)OCC(O)c1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.45
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GAA P10253 1/20 0.39
GABBR2 O75899 2/20 0.39
GABBR1 Q9UBS5 2/20 0.39
BRD4 O60885 1/20 0.37
PYGL P06737 1/20 0.36
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GRIN2D O15399 3/20 0.35
GRIN3B O60391 3/20 0.35
GRIN1 Q05586 3/20 0.35
GRIN2A Q12879 3/20 0.35
GRIN2B Q13224 3/20 0.35
GRIN2C Q14957 3/20 0.35

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
SCHEMBL2541787 1.00 AOC3 (0.45) AOC3LMNASMN1; SMN2GAAGABBR2
SCHEMBL5157831 1.00 AOC3 (0.45) AOC3LMNASMN1; SMN2GAAGABBR2
SCHEMBL14646436 0.84 ALDH1A1 (0.40) LMNAADRB2ADRB1ADRB3KDM4E
SCHEMBL2538436 0.83 AOC3 (0.45) AOC3LMNAGABBR2GABBR1ADRB2
SCHEMBL2538440 0.83 AOC3 (0.45) AOC3LMNAGABBR2GABBR1ADRB2
SCHEMBL2541606 0.82 LMNA (0.48) AOC3LMNAKDM4E
SCHEMBL2542325 0.82 LMNA (0.48) AOC3LMNAKDM4E
SCHEMBL5159743 0.82 LMNA (0.48) AOC3LMNAKDM4E
SCHEMBL18101847 0.82 LMNA (0.38) AOC3LMNASMN1; SMN2GABBR2GABBR1
SCHEMBL2542059 0.82 SLC6A3 (0.41) LMNASMN1; SMN2ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1236714-B1 ACETALSULFONATE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND PROCESS FOR PRODUCING STYRENE OXIDE DERIVATIVE MITSUBISHI RAYON CO (JP) 2007-01-17 EP disclosed
US-6642395-B1 Esterifying mandelic acid derivative; protecting hydroxyl group and reducing ester; sulfonating and epoxidizing MITSUBISHI RAYON CO., LTD. (JP) 2003-11-04 US disclosed
EP-1236714-A1 ACETALSULFONATE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND PROCESS FOR PRODUCING STYRENE OXIDE DERIVATIVE Mitsubishi Rayon Co., Ltd. (JP) 2002-09-04 EP disclosed