SCHEMBL1242008

SCHEMBL1242008

CC(C)(C)OC(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.56
MMP2 P08253 4/20 0.53
CA2 P00918 3/20 0.53
MMP1 P03956 3/20 0.53
MMP9 P14780 3/20 0.53
MMP13 P45452 3/20 0.53
CA1 P00915 2/20 0.53
CA12 O43570 2/20 0.53
CA9 Q16790 2/20 0.53
CA14 Q9ULX7 2/20 0.53
MMP8 P22894 2/20 0.53
CA3 P07451 1/20 0.53
CA4 P22748 1/20 0.53
CA6 P23280 1/20 0.53
CA5A P35218 1/20 0.53
CA7 P43166 1/20 0.53
CA13 Q8N1Q1 1/20 0.53
CA5B Q9Y2D0 1/20 0.53
FLT1 P17948 2/20 0.51
FLT4 P35916 2/20 0.51

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
SCHEMBL13866357 0.86 ALOX5 (0.75) ALOX5MMP2CA2MMP1MMP9
SCHEMBL28931721 0.85 ALOX5 (0.48) ALOX5MMP2CA2MMP1MMP9
SCHEMBL9815588 0.84 CA2 (0.59) MMP2CA2MMP1MMP9MMP13
SCHEMBL20047462 0.82 PPARA (0.47) ALOX5MMP2CA2MMP1MMP9
SCHEMBL18519523 0.82 KMT2A (0.48) ALOX5MMP2CA2MMP1MMP9
SCHEMBL497667 0.81 NFKB1 (0.53) MMP2CA2MMP1MMP9MMP13
SCHEMBL25339171 0.81 MEN1 (0.52) ALOX5MMP2CA2MMP1MMP9
SCHEMBL4946371 0.81 KMT2A (0.68) ALOX5MMP2CA2MMP1MMP9
SCHEMBL30191314 0.80 MMP2 (0.50) ALOX5MMP2CA2MMP1MMP9
SCHEMBL4432604 0.80 EGFR (0.50) ALOX5MMP2CA2MMP1MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109836360-B Preparation method of edoxaban tosylate intermediate and intermediate compound 南京恩泰医药科技有限公司 2021-08-13 CN claimed
CN-109836360-A A kind of preparation method and midbody compound of toluenesulfonic acid Yi Dushaban intermediate 南京恩泰医药科技有限公司 2019-06-04 CN claimed
EP-4634184-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING KINASES VIA UBIQUITIN PROTEOSOME PATHWAY Crossfire Oncology Holding B.V. (NL) 2025-10-22 EP disclosed
US-20250074911-A1 MACROCYCLIC BTK INHIBITORS CROSSFIRE ONCOLOGY HOLDING B.V. (NL) 2025-03-06 US disclosed
WO-2024256568-A1 SALT AND CRYSTAL FORMS OF A MACROCYCLIC BTK INHIBITOR CROSSFIRE ONCOLOGY HOLDING B.V. (NL) 2024-12-19 WO disclosed
WO-2024245578-A1 THERAPEUTIC COMBINATIONS OF AN IRREVERSIBLE BTK INHIBITOR AND A MACROCYCLIC REVERSIBLE BTK INHIBITOR NETHERLANDS TRANSLATIONAL RESEARCH CENTER HOLDING B.V. (NL) 2024-12-05 WO disclosed
WO-2024246287-A1 MEDICAL USE OF A MACROCYCLIC REVERSIBLE BTK INHIBITOR CROSSFIRE ONCOLOGY HOLDING B.V. (NL) 2024-12-05 WO disclosed
EP-4448523-A1 MACROCYCLIC BTK INHIBITORS Crossfire Oncology Holding B.V. (NL) 2024-10-23 EP disclosed
EP-4448521-A1 REVERSIBLE MACROCYCLIC KINASE INHIBITORS Crossfire Oncology Holding B.V. (NL) 2024-10-23 EP disclosed
CN-118696041-A Macrocyclic BTK inhibitors 克罗斯费尔肿瘤学控股有限公司 2024-09-24 CN disclosed
WO-2024126617-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING KINASES VIA UBIQUITIN PROTEOSOME PATHWAY CROSSFIRE ONCOLOGY HOLDING B.V. (NL) 2024-06-20 WO disclosed
CN-109836360-B Preparation method of edoxaban tosylate intermediate and intermediate compound 南京恩泰医药科技有限公司 2021-08-13 CN disclosed
CN-109836360-A A kind of preparation method and midbody compound of toluenesulfonic acid Yi Dushaban intermediate 南京恩泰医药科技有限公司 2019-06-04 CN disclosed
CN-109836360-A A kind of preparation method and midbody compound of toluenesulfonic acid Yi Dushaban intermediate 南京恩泰医药科技有限公司 2019-06-04 CN disclosed
WO-2017156181-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. (US) 2017-09-14 WO disclosed
WO-2017156181-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. (US) 2017-09-14 WO disclosed
US-7879808-B2 potent activity against resistant pneumococci; for treating domestic fowl MEIJI SEIKA KAISHA, LTD. (JP) 2011-02-01 US disclosed
US-20100210570-A1 LINCOMYCIN DERIVATIVES AND ANTIMICROBIAL AGENTS COMPRISING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2010-08-19 US disclosed
EP-2151447-A1 LINCOMYCIN DERIVATIVES AND ANTIBACTERIAL AGENTS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Meiji Seika Kaisha Ltd. (JP) 2010-02-10 EP disclosed
WO-2008076778-A1 4-AMINO-1H-PYRIMIDIN-2-ONE BASED COMPOUNDS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE LEXICON PHARMACEUTICALS, INC. (US) 2008-06-26 WO 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 (2 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-20100210570-A1 LINCOMYCIN DERIVATIVES AND ANTIMICROBIAL AGENTS COMPRISING THE SAME AS ACTIVE INGREDIENT LAS1L, LCLAT1, LYPLA1 ALOX5 1664/4885MMP2 632/4885CA2 4260/4885
US-20250074911-A1 MACROCYCLIC BTK INHIBITORS BTK, LYN, LCK ALOX5 3554/4885MMP2 4377/4885CA2 3735/4885

“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.