SCHEMBL647196

SCHEMBL647196

CC(C)(C)OC(=O)N(CC[Si](C)(C)C)S(=O)(=O)N(CC(=O)O)c1ccc(Cc2ccccc2OS(C)(=O)=O)cc1O

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
STAT5B P51692 1/20 0.33
KEAP1 Q14145 16/20 0.33
NFE2L2 Q16236 15/20 0.33

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
SCHEMBL647977 0.90 KEAP1 (0.41) KEAP1NFE2L2
SCHEMBL647180 0.69 KEAP1 (0.39) STAT5BKEAP1NFE2L2
SCHEMBL12971500 0.61 CYP19A1 (0.34) KEAP1NFE2L2
SCHEMBL29242665 0.58 NQO2 (0.54)
SCHEMBL11103498 0.58 CXCL8 (0.53)
SCHEMBL6257485 0.58 AKR1B1 (0.39) STAT5B
SCHEMBL4880111 0.58 CA12 (0.45)
SCHEMBL7707821 0.57 AKT1 (0.48) STAT5B
SCHEMBL4842133 0.56 SMN1; SMN2 (0.38) KEAP1NFE2L2
SCHEMBL4841484 0.56 KMT2A (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1963294-B1 1,2,5-THIAZOLIDINE DERIVATIVES USEFUL FOR TREATING CONDITIONS MEDIATED BY PROTEIN TYROSINE PHOSPHATASES (PTPASE) NOVARTIS AG (CH) 2012-10-10 EP disclosed
US-8119666-B2 1,2,5-thiazolidine derivatives useful for treating conditions mediated by protein tyrosine phosphatases (PTPase) NOVARTIS AG (CH) 2012-02-21 US disclosed
US-20080293776-A1 1,2,5-Thiazolidine Derivatives Useful for Treating Conditions Mediated by Protein Tyrosine Phosphatases (Ptpase) NOVARTIS AG (CH) 2008-11-27 US 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-20080293776-A1 1,2,5-Thiazolidine Derivatives Useful for Treating Conditions Mediated by Protein Tyrosine Phosphatases (Ptpase) PTPRS, PTPN5, PTPRR STAT5B 1223/4885KEAP1 1827/4885NFE2L2 1890/4885

“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.