SCHEMBL288536

SCHEMBL288536

[CH2]CS(=O)(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.55
CA1 P00915 7/20 0.55
CA9 Q16790 7/20 0.55
CA12 O43570 6/20 0.55
CA14 Q9ULX7 5/20 0.55
CA3 P07451 3/20 0.55
CA4 P22748 3/20 0.55
CA6 P23280 3/20 0.55
CA5A P35218 3/20 0.55
CA7 P43166 3/20 0.55
CA13 Q8N1Q1 3/20 0.55
CA5B Q9Y2D0 3/20 0.55
HSD11B1 P28845 1/20 0.50
MMP1 P03956 1/20 0.50
MMP2 P08253 1/20 0.50
MMP9 P14780 1/20 0.50
MMP8 P22894 1/20 0.50
MMP13 P45452 1/20 0.50
PKM P14618 1/20 0.49
ALDH1A1 P00352 2/20 0.46

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
SCHEMBL4253160 0.83 CA2 (0.59) CA2CA1CA9CA12CA14
SCHEMBL19126866 0.83 CA2 (0.59) CA2CA1CA9CA12CA14
SCHEMBL2296287 0.81 CA1 (0.57) CA2CA1CA9CA12CA14
SCHEMBL28602028 0.80 CA1 (0.57) CA2CA1CA9CA12CA14
SCHEMBL27267578 0.79 CA1 (0.61) CA2CA1CA9CA12CA14
SCHEMBL1661124 0.79 CA1 (0.55) CA2CA1CA9CA12CA14
SCHEMBL14416006 0.79 CA2 (0.55) CA2CA1CA9CA12CA14
SCHEMBL9702100 0.79 CA1 (0.55) CA2CA1CA9CA12CA14
SCHEMBL11260866 0.79 CA1 (0.55) CA2CA1CA9CA12CA14
SCHEMBL25118612 0.76 CA1 (0.52) CA2CA1CA9CA12CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109232716-A The high penetrating power prodrugs composition of polypeptide and polypeptide related compound 上海泰飞尔生化技术有限公司 2019-01-18 CN claimed
CN-102365341-B Alkali generating agent, photosensitive resin composition, material for pattern formation containing the photosensitive resin composition, method for pattern formation using the photosensitive resin composition, and article DAINIPPON PRINTING CO LTD 2014-12-31 CN claimed
US-8846898-B2 Phosphinoamidite carboxylates and analogs thereof in the synthesis of oligonucleotide having reduced internucleotide charge Lieure Cornu LLC (US) 2014-09-30 US claimed
CN-102459313-A High penetration prodrug compositions of polypeptides and polypeptide-related compounds SHANGHAI TECHFIELDS BIOCHEM CO LTD 2012-05-16 CN claimed
EP-2427475-A1 HIGH PENETRATION PRODRUG COMPOSITIONS OF PEPTIDES AND PEPTIDE-RELATED COMPOUNDS Yu, Chongxi (US) 2012-03-14 EP claimed
US-20100311960-A1 Phosphinoamidite Carboxylates and Analogs Thereof in the Synthesis of Oligonucleotide Having Reduced Internucleotide Charge LIEVRE CORNU LLC (US) 2010-12-09 US claimed
WO-2010127640-A1 HIGH PENETRATION PRODRUG COMPOSITIONS OF PEPTIDES AND PEPTIDE-RELATED COMPOUNDS TECHFIELDS BIOCHEM CO., LTD. (CN) 2010-11-11 WO claimed
US-7745591-B2 phosphinocarboxylate and phosphonocarboxylate oligonucleotides having enhanced nuclease resistance Lievre Cornu, LLC (US) 2010-06-29 US claimed
US-7427679-B2 Precursors for two-step polynucleotide synthesis AGILENT TECHNOLOGIES, INC. (US) 2008-09-23 US claimed
US-7417139-B2 Method for polynucleotide synthesis AGILENT TECHNOLOGIES, INC. (US) 2008-08-26 US claimed
US-7385050-B2 Cleavable linker for polynucleotide synthesis AGILENT TECHNOLOGIES, INC. (US) 2008-06-10 US claimed
US-7193077-B2 Exocyclic amine triaryl methyl protecting groups in two-step polynucleotide synthesis AGILENT TECHNOLOGIES, INC. (US) 2007-03-20 US claimed
US-20060293511-A1 phosphinocarboxylate and phosphonocarboxylate oligonucleotides having enhanced nuclease resistance LIEVRE CORNU LLC (US) 2006-12-28 US claimed
US-7067641-B2 Phosphinoamidite carboxylates and analogs thereof in the synthesis of oligonucleotides having reduced internucleotide charge LIEVRE CORNU LLC (US) 2006-06-27 US claimed
US-20050048601-A1 Method for polynucleotide synthesis REGENTS OF THE UNIVERSITY OF COLORADO, THE 2005-03-03 US claimed
US-20050048497-A1 Cleavable linker for polynucleotide synthesis THE REGENTS OF THE UNIVERSITY OF COLORADO 2005-03-03 US claimed
EP-1510523-A1 Precurors for two-step polynucleotide synthesis Agilent Technologies Inc (US) 2005-03-02 EP claimed
US-20040116687-A1 oligonucleotides having reduced internucleotide charge and enhanced nuclease resistance AGILENT TECHNOLOGIES, INC. 2004-06-17 US claimed
EP-0648220-A1 DEUTERATED NUCLEOSIDES CHATTOPADHYAYA, Jyoti (SE) 1995-04-19 EP claimed
WO-1993025566-A1 DEUTERATED NUCLEOSIDES CHATTOPADHYAYA JYOTI (SE) 1993-12-23 WO claimed

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

For each of this compound's patents that has machine-readable text (4 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-20050048601-A1 Method for polynucleotide synthesis POLN, RNGTT, NSUN2 CA2 4815/4885CA1 4682/4885CA9 4786/4885
US-20100311960-A1 Phosphinoamidite Carboxylates and Analogs Thereof in the Synthesis of Oligonucleotide Having Reduced Internucleotide Charge NSUN2, POLL, DUT CA2 1707/4885CA1 2416/4885CA9 1578/4885
US-20050048497-A1 Cleavable linker for polynucleotide synthesis TYMP, POLN, CPSF1 CA2 4457/4885CA1 3326/4885CA9 3788/4885
US-20060293511-A1 phosphinocarboxylate and phosphonocarboxylate oligonucleotides having enhanced nuclease resistance NSUN2, ADAR, POLL CA2 2016/4885CA1 2083/4885CA9 744/4885

“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.