Sulfuric Acid Diethyl Ester

Sulfuric Acid Diethyl Ester

SCHEMBL7575908

CCOS(=O)(=O)OCC.NN

nearest known ligand 0.58

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Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 18/20 0.58
CA2 P00918 18/20 0.58
CA9 Q16790 12/20 0.35
CA12 O43570 5/20 0.33
CA7 P43166 5/20 0.33
CA14 Q9ULX7 4/20 0.33
CA3 P07451 2/20 0.33
CA4 P22748 2/20 0.33
CA6 P23280 2/20 0.33
CA5A P35218 2/20 0.33
CA5B Q9Y2D0 2/20 0.33
ALOX15 P16050 2/20 0.30
KDM4E B2RXH2 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MMP9 P14780 1/20 0.30
TSHR P16473 1/20 0.30

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
Sulfuric Acid Diethyl Ester SCHEMBL28170893 0.93 CA1 (0.56) CA1CA2CA9CA12CA7
Sulfuric Acid Diethyl Ester SCHEMBL1769 0.93
Sulfuric Acid Diethyl Ester SCHEMBL28919288 0.90 CA1 (0.53) CA1CA2CA9ALOX15KDM4E
Sulfuric Acid Diethyl Ester SCHEMBL28570449 0.90 CA1 (0.53) CA1CA2CA9ALOX15KDM4E
Sulfuric Acid Diethyl Ester SCHEMBL29104224 0.90 CA1 (0.53) CA1CA2CA9ALOX15KDM4E
Sulfuric Acid Diethyl Ester SCHEMBL4284879 0.90 CA1 (0.53) CA1CA2CA9ALOX15KDM4E
Sulfuric Acid Diethyl Ester SCHEMBL18038940 0.90 CA1 (0.53) CA1CA2CA9ALOX15KDM4E
Sulfuric Acid Diethyl Ester SCHEMBL11808247 0.90 CA1 (0.53) CA1CA2CA9ALOX15KDM4E
Sulfuric Acid Diethyl Ester SCHEMBL20853617 0.90 CA1 (0.53) CA1CA2CA9ALOX15KDM4E
Sulfuric Acid Diethyl Ester SCHEMBL28433772 0.90 CA1 (0.53) CA1CA2CA9ALOX15KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1028116-B1 Process for the production of taxol analogues 10-deacetyl taxol A, B, and C COUNCIL SCIENT IND RES (IN) 2002-10-02 EP claimed
EP-1028116-A1 Process for the production of taxol analogues 10-deacetyl taxol A, B, and C Council of Scientific & Industrial Research (IN) 2000-08-16 EP claimed
US-6028206-A IMPROVING THE CONVERSION OF THE TAXOL ANALOGUES 7-XYLOSYL-10-DEACETYL TAXOLS A,B,C INTO THE INTERMEDIATES 10-DEACETYL TAXOLS A,B,C; ANTITUMOR AGENTS TREATING CANCER COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2000-02-22 US claimed
EP-1028116-B1 Process for the production of taxol analogues 10-deacetyl taxol A, B, and C COUNCIL SCIENT IND RES (IN) 2002-10-02 EP disclosed
EP-1028116-A1 Process for the production of taxol analogues 10-deacetyl taxol A, B, and C Council of Scientific & Industrial Research (IN) 2000-08-16 EP disclosed
US-6028206-A IMPROVING THE CONVERSION OF THE TAXOL ANALOGUES 7-XYLOSYL-10-DEACETYL TAXOLS A,B,C INTO THE INTERMEDIATES 10-DEACETYL TAXOLS A,B,C; ANTITUMOR AGENTS TREATING CANCER COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2000-02-22 US disclosed