SCHEMBL259736

SCHEMBL259736

Cc1ccc(S(=O)(=O)OCP(=O)(OC(C)C)OC(C)C)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.38
GAA P10253 2/20 0.37
CA9 Q16790 5/20 0.36
CA12 O43570 4/20 0.36
MMP2 P08253 2/20 0.36
CA14 Q9ULX7 1/20 0.36
GBA1 P04062 1/20 0.36
ALDH1A1 P00352 5/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CA2 P00918 4/20 0.36
VDR P11473 1/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
CA1 P00915 4/20 0.35
CA7 P43166 2/20 0.35
CA3 P07451 1/20 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
SCHEMBL22262073 0.89 STAT3 (0.34) STAT3GAACA9CA12MMP2
SCHEMBL22262072 0.89 STAT3 (0.34) STAT3GAACA9CA12MMP2
SCHEMBL1030711 0.87 CA12 (0.39) STAT3GAACA9CA12MMP2
SCHEMBL12300749 0.86 CA12 (0.38) GAACA9CA12MMP2CA14
SCHEMBL1375594 0.86 L3MBTL1 (0.43) GAACA9CA12ALDH1A1MEN1
SCHEMBL8622516 0.85 MMP2 (0.41) STAT3GAACA9CA12MMP2
SCHEMBL259735 0.85 STAT3 (0.36) STAT3GAACA9CA12MMP2
SCHEMBL13992035 0.85 STAT3 (0.36) STAT3GAACA9CA12MMP2
SCHEMBL8871679 0.82 STAT3 (0.43) STAT3GAACA9CA12ALDH1A1
SCHEMBL139911 0.79 CA12 (0.41) STAT3GAACA9CA12ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111187325-A Anti-tumor (4' R) -methyl- α -L-ribofuranose nucleoside and preparation method thereof 郑州大学 2020-05-22 CN claimed
WO-2015051874-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF TENOFOVIR DISOPROXIL AND PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF ZENTIVA, K.S. (CZ) 2015-04-16 WO claimed
EP-2860185-A1 An improved process for the preparation of Tenofovir disoproxil and pharmaceutically acceptable salts thereof Zentiva, k.s. (CZ) 2015-04-15 EP claimed
US-5733896-A VIRICIDE FOR RETROVIRUS INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 1998-03-31 US claimed
CN-111187325-B Antitumor (4' R) -methyl-alpha-L-ribofuranose nucleoside and preparation method thereof 郑州大学 2022-09-02 CN disclosed
US-11292812-B2 3′3′-cyclic dinucleotides INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I. (CZ) 2022-04-05 US disclosed
US-11149052-B2 2′3′-cyclic dinucleotides INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I. (CZ) 2021-10-19 US disclosed
EP-3774832-A1 3'3'-CYCLIC DINUCLEOTIDES Institute of Organic Chemistry and Biochemistry ASCR, V.V.I. (CZ) 2021-02-17 EP disclosed
EP-3774831-A1 2'3'-CYCLIC DINUCLEOTIDES Institute of Organic Chemistry and Biochemistry ASCR, V.V.I. (CZ) 2021-02-17 EP disclosed
CN-111187325-A Anti-tumor (4' R) -methyl- α -L-ribofuranose nucleoside and preparation method thereof 郑州大学 2020-05-22 CN disclosed
CN-108586532-B Preparation method of tenofovir disoproxil fumarate 科兴生物制药股份有限公司 2020-05-08 CN disclosed
US-20190322695-A1 2'3'-CYCLIC DINUCLEOTIDES INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR,V.V.I. (CZ) 2019-10-24 US disclosed
EP-0630381-A1 ANTIVIRAL ACYCLIC PHOSPHONOMETHOXYALKYL SUBSTITUTED, ALKENYL AND ALKYNYL PURINE AND PYRIMIDINE DERIVATIVES. ACAD OF SCIENCE CZECH REPUBLIC (CS) 1994-12-28 EP disclosed
US-5302585-A Viricides, HIV virus INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CS) 1994-04-12 US disclosed
WO-1994003467-A2 ANTIRETROVIRAL ENANTIOMERIC NUCLEOTIDE ANALOGS INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 1994-02-17 WO disclosed
EP-0550574-A1 HETEROCYCLIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1993-07-14 EP disclosed
WO-1993007157-A1 ANTIVIRAL ACYCLIC PHOSPHONOMETHOXYALKYL SUBSTITUTED, ALKENYL AND ALKYNYL PURINE AND PYRIMIDINE DERIVATIVES INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OFTHE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 1993-04-15 WO disclosed
WO-1992005180-A1 HETEROCYCLIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1992-04-02 WO disclosed
EP-0454427-A1 Antiretroviral bases Institute of Organic Chemistry and Biochemistry of the Academy of Sciences of the Czech Republic (CZ) 1991-10-30 EP disclosed
EP-0452935-A1 Chiral 2-(phosphonomethoxy)propyl guanines as antiviral agents INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CS) 1991-10-23 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11149052-B2 2′3′-cyclic dinucleotides STING1, MAVS, CGAS STAT3 1149/4885GAA 3558/4885CA9 4844/4885
US-20190322695-A1 2'3'-CYCLIC DINUCLEOTIDES STING1, MAVS, CGAS STAT3 1297/4885GAA 3577/4885CA9 4848/4885
US-11292812-B2 3′3′-cyclic dinucleotides STING1, CGAS, MAVS STAT3 1461/4885GAA 3693/4885CA9 4844/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.