SCHEMBL5492640

SCHEMBL5492640

CC(N1CCOCC1)S(=O)(=O)O.[CaH2]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.36
PKM P14618 1/20 0.36
ALDH1A1 P00352 5/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TSHR P16473 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KCNA5 P22460 1/20 0.33
GAA P10253 1/20 0.33
ACHE P22303 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
SCHEMBL29926166 0.98 CA12 (0.39) CA12CA7CA14SMN1; SMN2PKM
SCHEMBL49152 0.98 CA12 (0.39) CA12CA7CA14SMN1; SMN2PKM
SCHEMBL29027428 0.96 CA12 (0.38) CA12CA7CA14SMN1; SMN2PKM
SCHEMBL4566523 0.96 CA12 (0.38) CA12CA7CA14SMN1; SMN2PKM
Water SCHEMBL730524 0.96 CA12 (0.38) CA12CA7CA14SMN1; SMN2PKM
Hydrochloric Acid SCHEMBL28285547 0.94 CA12 (0.37) CA12CA7CA14SMN1; SMN2PKM
SCHEMBL62393 0.82 KDM4E (0.32) LMNAKDM4EGAA
SCHEMBL15572838 0.78 CA12 (0.41) CA12CA7CA14SMN1; SMN2PKM
SCHEMBL4694756 0.78 CA12 (0.41) CA12CA7CA14SMN1; SMN2PKM
Water SCHEMBL28800260 0.78 KDM4E (0.30) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1111065-B1 Production of saccharide carboxylic acids ENSUIKO SUGAR REFINING (JP) 2007-09-26 EP disclosed
EP-0599646-B1 Production of saccharide carboxylic acids TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2002-09-18 EP disclosed
EP-1111065-A2 Production of saccharide carboxylic acids TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-06-27 EP disclosed
US-5635610-A FROM OXIDATION BY A MICROORGANISM BELONGING TO THE GENUS PSEUDOGLUCONOBACTER; RESISTANT TO ENZYMATIC DEGRADATION; IMPROVED WATER SOLUBILITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-06-03 US disclosed
US-5635611-A COMPLEXING DETRANYLGLUCURONIC ACID SALT WITH FERRIC HYDROXIDE SOL TO FORM A COMPLEX; RESISTANT TO ENZYMATIC DEGRADATION AND IMPROVED WATER SOLUBILITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-06-03 US disclosed
US-5629411-A RESISTANT TO ENZYMATIC DEGRATION, IMPROVED WATER SOLUBILITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-05-13 US disclosed
US-5434061-A Pseudogluconobacter TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-07-18 US disclosed
EP-0599646-A2 Production of saccharide carboxylic acids TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-06-01 EP disclosed