SCHEMBL6935497

SCHEMBL6935497

O=C(O)CC([Na])(C(=O)O)S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
CYP2D6 P10635 1/20 0.37
TSHR P16473 1/20 0.37
CYP2C19 P33261 1/20 0.37
HIF1A Q16665 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HMGCR P04035 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
ADRA1A P35348 1/20 0.33
ACLY P53396 3/20 0.32
CPT2 P23786 1/20 0.31
POLB P06746 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
SCHEMBL3808061 0.76 ALDH1A1 (0.37) ALDH1A1L3MBTL1
SCHEMBL7603931 0.74 ALDH1A1 (0.36) ALDH1A1L3MBTL1
SCHEMBL1129741 0.70 ALDH1A1 (0.42) ALDH1A1CYP2D6TSHRCYP2C19HIF1A
SCHEMBL6561842 0.70 ALDH1A1 (0.42) ALDH1A1CYP2D6TSHRCYP2C19HIF1A
SCHEMBL6570219 0.68 ALDH1A1 (0.46) ALDH1A1CYP2D6TSHRCYP2C19HIF1A
SCHEMBL28489478 0.68 ALDH1A1 (0.40) ALDH1A1CYP2D6TSHRCYP2C19HIF1A
SCHEMBL2521500 0.68 ALDH1A1 (0.40) ALDH1A1CYP2D6TSHRCYP2C19HIF1A
Ammonia Solution, Strong SCHEMBL11776041 0.68 ALDH1A1 (0.40) ALDH1A1CYP2D6TSHRCYP2C19HIF1A
SCHEMBL899527 0.67 ALDH1A1 (0.39) ALDH1A1CYP2D6TSHRCYP2C19HIF1A
SCHEMBL6429532 0.67 CYP2C19 (0.48) ALDH1A1CYP2D6TSHRCYP2C19HIF1A

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4048149-A SIZING AGENTS RHONE-POULENC INDUSTRIES (FR) 1977-09-13 US claimed
CN-108883615-B Mold release film 三菱化学株式会社 2020-11-10 CN disclosed
CN-107428135-B Mold release film 三菱化学株式会社 2019-12-24 CN disclosed
EP-2219592-B1 ULTRAVIOLET ABSORBER WATER-DISPERSED COMPOSITION BASF SE (DE) 2016-05-18 EP disclosed
US-6649679-B1 Blend containing acetoacetoxy-functional polymer not stabilized by surfactant; pressure sensitive adhesives, gelation inhibition; lamination EASTMAN CHEMICAL COMPANY 2003-11-18 US disclosed
EP-1023398-B1 STABLE WATERBORNE POLYMER COMPOSITIONS CONTAINING POLY(ALKYLENEIMINES) EASTMAN CHEM CO (US) 2002-12-18 EP disclosed
EP-1023402-B1 STABLE LOW FOAM WATERBORNE POLYMER COMPOSITIONS CONTAINING POLY(ALKYLENEIMINES) EASTMAN CHEM CO (US) 2002-11-20 EP disclosed
EP-1252251-A1 STABLE WATERBORNE POLYMER COMPOSITIONS CONTAINING POLY(ALKYLENIMINES) EASTMAN CHEMICAL COMPANY (US) 2002-10-30 EP disclosed
US-6262169-B1 IN COATING FORULATIONS EASTMAN CHEMICAL COMPANY 2001-07-17 US disclosed
WO-2001046332-A1 STABLE WATERBORNE POLYMER COMPOSITIONS CONTAINING POLY(ALKYLENIMINES) EASTMAN CHEMICAL COMPANY (US) 2001-06-28 WO disclosed
EP-1023398-A1 STABLE WATERBORNE POLYMER COMPOSITIONS CONTAINING POLY(ALKYLENEIMINES) EASTMAN CHEMICAL COMPANY (US) 2000-08-02 EP disclosed
EP-1023402-A1 STABLE LOW FOAM WATERBORNE POLYMER COMPOSITIONS CONTAINING POLY(ALKYLENEIMINES) EASTMAN CHEMICAL COMPANY (US) 2000-08-02 EP disclosed
EP-1019455-A1 STABLE WATERBORNE POLYMER COMPOSITIONS CONTAINING POLY(ALKYLENEIMINES) EASTMAN CHEMICAL COMPANY (US) 2000-07-19 EP disclosed
US-6005035-A NONIONIC SURFACTANTS WITH HYDROPHILIC-LIPOPHILIC BALANCE EASTMAN CHEMICAL COMPANY (US) 1999-12-21 US disclosed
US-5990224-A CURABLE COATINGS OBTAINED BY POLYMERIZATION OF AN UNSATURATED MONOMER HAVING AN ACETOACETOXY GROUP IN THE PRESENCE OF A PHOSPHATE-CONTAINING SURFACTANT AND POLYAMINE; GELATION INHIBITION; PROTECTIVE COATINGS AND SEALS; PAINTS, INKS, EASTMAN CHEMICAL COMPANY (US) 1999-11-23 US disclosed
WO-1999058608-A1 PROTONATED AMINES FOR CONTROLLED CROSSLINKING OF LATEX POLYMERS EASTMAN CHEMICAL COMPANY (US) 1999-11-18 WO disclosed
WO-1999014275-A1 STABLE WATERBORNE POLYMER COMPOSITIONS CONTAINING POLY(ALKYLENEIMINES) EASTMAN CHEMICAL COMPANY (US) 1999-03-25 WO disclosed
WO-1999014278-A1 STABLE WATERBORNE POLYMER COMPOSITIONS CONTAINING POLY(ALKYLENEIMINES) EASTMAN CHEMICAL COMPANY (US) 1999-03-25 WO disclosed
WO-1999014279-A1 STABLE LOW FOAM WATERBORNE POLYMER COMPOSITIONS CONTAINING POLY(ALKYLENEIMINES) EASTMAN CHEMICAL COMPANY (US) 1999-03-25 WO disclosed
US-4048149-A SIZING AGENTS RHONE-POULENC INDUSTRIES (FR) 1977-09-13 US disclosed