SCHEMBL5481869

SCHEMBL5481869

O=S(=O)(O)CCC(O)CO.[NaH]

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.43
LMNA P02545 3/20 0.38
ALDH1A1 P00352 1/20 0.38
PTGS1 P23219 1/20 0.36
PDE4A P27815 1/20 0.36
SLC6A6 P31641 1/20 0.36
CYP2C19 P33261 1/20 0.36
BLM P54132 1/20 0.36
APP P05067 1/20 0.33
TP53 P04637 1/20 0.31

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
SCHEMBL5485715 1.00 THRB (0.43) THRBLMNAALDH1A1PTGS1PDE4A
SCHEMBL195616 0.97 THRB (0.46) THRBLMNAALDH1A1PTGS1PDE4A
SCHEMBL15141499 0.83 APP (0.42) THRBLMNAALDH1A1PTGS1PDE4A
SCHEMBL18091454 0.81 APP (0.41) THRBLMNAALDH1A1PTGS1PDE4A
SCHEMBL18091442 0.80 THRB (0.43) THRBLMNAPTGS1PDE4ASLC6A6
SCHEMBL7461542 0.79 APP (0.39) THRBLMNAALDH1A1PTGS1PDE4A
SCHEMBL15754446 0.78 PTGS1 (0.35) LMNAPTGS1PDE4ASLC6A6CYP2C19
SCHEMBL15754668 0.76 S1PR2 (0.36) LMNAPTGS1PDE4ASLC6A6CYP2C19
SCHEMBL18091453 0.76 PTPN1 (0.37) LMNAPTGS1PDE4ASLC6A6CYP2C19
SCHEMBL2058183 0.76 THRB (0.52) THRBLMNAALDH1A1PTGS1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1425311-A4 CYCLODEXTRIN SULFONATES, GUEST INCLUSION COMPLEXES, METHODS OF MAKING THE SAME AND RELATED MATERIALS EASTMAN CHEM CO (US) 2004-12-01 EP claimed
EP-1425311-A2 CYCLODEXTRIN SULFONATES, GUEST INCLUSION COMPLEXES, METHODS OF MAKING THE SAME AND RELATED MATERIALS EASTMAN CHEMICAL COMPANY (US) 2004-06-09 EP claimed
US-20040054164-A1 Cyclodextrin sulfonates, guest inclusion complexes, methods of making the same and related materials EASTMAN CHEMICAL COMPANY (US) 2004-03-18 US claimed
US-20020128468-A1 Cyclodextrin sulfonates, guest inclusion complexes methods of making the same and related materials BUCHANAN CHARLES M (US) 2002-09-12 US claimed
WO-2002055562-A2 CYCLODEXTRIN SULFONATES, GUEST INCLUSION COMPLEXES, METHODS OF MAKING THE SAME AND RELATED MATERIALS EASTMAN CHEM CO (US) 2002-07-18 WO claimed
EP-4342887-A1 METHOD FOR PREPARING CYCLIC SULFONIC ACID ESTER DERIVATIVE COMPOUND LG Chem, Ltd. (KR) 2024-03-27 EP disclosed
CN-117561243-A Process for the preparation of cyclic sulfonate derivative compounds 株式会社LG化学 2024-02-13 CN disclosed
WO-2023132713-A1 METHOD FOR PREPARING CYCLIC SULFONIC ACID ESTER DERIVATIVE COMPOUND 주식회사 엘지화학 2023-07-13 WO disclosed
US-7189798-B2 Composition containing mixture of dihydroxybutane sulfonates EASTMAN CHEMICAL COMPANY (US) 2007-03-13 US disclosed
EP-1425311-A4 CYCLODEXTRIN SULFONATES, GUEST INCLUSION COMPLEXES, METHODS OF MAKING THE SAME AND RELATED MATERIALS EASTMAN CHEM CO (US) 2004-12-01 EP disclosed
EP-1425311-A2 CYCLODEXTRIN SULFONATES, GUEST INCLUSION COMPLEXES, METHODS OF MAKING THE SAME AND RELATED MATERIALS EASTMAN CHEMICAL COMPANY (US) 2004-06-09 EP disclosed
US-20040054164-A1 Cyclodextrin sulfonates, guest inclusion complexes, methods of making the same and related materials EASTMAN CHEMICAL COMPANY (US) 2004-03-18 US disclosed
US-6610671-B2 Cyclodextrin derivatives for use in cosmetics, pharmacolog, cosmetic, or nutrients EASTMAN CHEMICAL COMPANY 2003-08-26 US disclosed
US-20020128468-A1 Cyclodextrin sulfonates, guest inclusion complexes methods of making the same and related materials BUCHANAN CHARLES M (US) 2002-09-12 US disclosed
WO-2002055562-A2 CYCLODEXTRIN SULFONATES, GUEST INCLUSION COMPLEXES, METHODS OF MAKING THE SAME AND RELATED MATERIALS EASTMAN CHEM CO (US) 2002-07-18 WO disclosed