SCHEMBL1268593

SCHEMBL1268593

CC(O[C]=O)S(=O)(=O)c1cccc2c(N(C)C)cccc12

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.54
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
HTT P42858 1/20 0.49
HIF1A Q16665 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
F2 P00734 3/20 0.47
PRSS1 P07477 3/20 0.47
PRSS2 P07478 3/20 0.47
PRSS3 P35030 3/20 0.47
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.47
EDNRA P25101 8/20 0.45
KDM4E B2RXH2 1/20 0.42
NSD2 O96028 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL3762979 0.81 CA2 (0.54) CA2CYP1A2CYP2C19HTTHIF1A
SCHEMBL1105200 0.81 CA2 (0.65) CA2CYP1A2CYP2C19HTTHIF1A
SCHEMBL9041969 0.80 CA1 (0.46) CA2F2PRSS1PRSS2PRSS3
SCHEMBL7558142 0.78 CA2 (0.61) CA2CYP1A2CYP2C19HTTHIF1A
SCHEMBL6046339 0.78 CA2 (0.61) CA2CYP1A2CYP2C19HTTHIF1A
SCHEMBL12760595 0.74 CA2 (0.59) CA2CYP1A2CYP2C19HTTHIF1A
SCHEMBL27495668 0.74 CA2 (0.64) CA2CYP1A2CYP2C19HTTHIF1A
SCHEMBL28267397 0.73 CA2 (0.55) CA2CYP1A2CYP2C19HTTHIF1A
SCHEMBL9019311 0.72 CA2 (0.71) CA2CYP1A2CYP2C19HTTHIF1A
SCHEMBL1131010 0.72 CA2 (0.71) CA2CYP1A2CYP2C19HTTHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6048975-A USE OF DANSYLETHOXYCARBONYL GROUP AS BASE-LABILE 5'-HYDROXYL PROTECTIVE GROUP; EASE OF DETECTION AND EASE OF ELIMINATION WITH BY-PRODUCT INHIBITION FOR HIGH YIELD SYNTHESIS IN VERY SMALL QUANTITIES HOECHST AKTIENGESELLSCHAFT (DE) 2000-04-11 US claimed
US-5945524-A NUCLEOSIDE WITH DANSYLETHOXYCARBONYL GROUP AS BASE-LABILE 5'-HYDROXYL PROTECTIVE GROUP; FOR EFFICIENT SYNTHESIS HOECHST AKTIENGESELLSCHAFT (DE) 1999-08-31 US claimed
EP-0475443-B1 Chemical synthesis of oligonucleotides HOECHST AG (DE) 1994-10-19 EP claimed
JP-5320122-A None JP disclosed
EP-2955171-A1 MANUFACTURE PROCESS OF N-(5-CHLOROSALICYLOYL)-8-AMINOCAPRYLIC ACID Novartis AG (CH) 2015-12-16 EP disclosed
EP-1838664-B1 MANUFACTURE PROCESS OF N-SUBSTITUTED SALICYLAMIDES NOVARTIS AG (CH) 2015-07-15 EP disclosed
US-8461385-B2 Manufacture process of organic compounds NOVARTIS AG (CH) 2013-06-11 US disclosed
EP-1212338-B1 Nucleoside derivatives with photolabile protective groups DEUTSCHES KREBSFORSCH (DE) 2012-11-21 EP disclosed
US-8314071-B2 Bioactive molecules from co-cultivation of microbes MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-11-20 US disclosed
US-8026383-B2 Process for the preparation of intermediates useful in the synthesis of statin derivatives BASF SE (DE) 2011-09-27 US disclosed
US-20110046411-A1 PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL IN THE SYNTHESIS OF STATIN DERIVATIVES CIBA SPECIALTY CHEMICALS CORPORATION 2011-02-24 US disclosed
US-5945524-A NUCLEOSIDE WITH DANSYLETHOXYCARBONYL GROUP AS BASE-LABILE 5'-HYDROXYL PROTECTIVE GROUP; FOR EFFICIENT SYNTHESIS HOECHST AKTIENGESELLSCHAFT (DE) 1999-08-31 US disclosed
WO-1999024452-A9 PYRIMIDINE DERIVATIVES FOR LABELED BINDING PARTNERS ISIS PHARMACEUTICALS INC (US) 1999-08-12 WO disclosed
WO-1999024452-A2 PYRIMIDINE DERIVATIVES FOR LABELED BINDING PARTNERS ISIS PHARMACEUTICALS, INC. (US) 1999-05-20 WO disclosed
US-5631362-A FORMING DNA AND RNA BY POLYCONDENSATION OF MONONUCLEOTIDES WITH PROTECTIVE SULFONYLALKYL DIMETHYLAMINONAPHTHALENE GROUPS FOR ALKOXY FURAN GROUPS HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-20 US disclosed
US-5631362-A FORMING DNA AND RNA BY POLYCONDENSATION OF MONONUCLEOTIDES WITH PROTECTIVE SULFONYLALKYL DIMETHYLAMINONAPHTHALENE GROUPS FOR ALKOXY FURAN GROUPS HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-20 US disclosed
EP-0475443-B1 Chemical synthesis of oligonucleotides HOECHST AG (DE) 1994-10-19 EP disclosed
JP-H05320122-A CHEMICAL SYNTHESIS OF OLIGONUCLEOTIDE HOECHST AG 1993-12-03 JP disclosed
EP-0475443-A2 Chemical synthesis of oligonucleotides HOECHST AKTIENGESELLSCHAFT (DE) 1992-03-18 EP disclosed
EP-0475443-A2 Chemical synthesis of oligonucleotides HOECHST AKTIENGESELLSCHAFT (DE) 1992-03-18 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 (1 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-20110046411-A1 PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL IN THE SYNTHESIS OF STATIN DERIVATIVES HMGCR, SREBF1, LCAT CA2 910/4885CYP1A2 200/4885CYP2C19 209/4885

“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.