SCHEMBL2991879

SCHEMBL2991879

O=S(=O)(NS(=O)(=O)C(F)(F)C(F)(F)Sc1ccccc1)C(F)(F)F.[LiH]

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 5/20 0.42
PTGS2 P35354 4/20 0.42
CA2 P00918 4/20 0.37
PTPN1 P18031 2/20 0.33
PTPN11 Q06124 1/20 0.33
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CA1 P00915 1/20 0.31
PTPRZ1 P23471 1/20 0.30

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
SCHEMBL2989976 0.95 PTGS1 (0.38) PTGS1PTGS2CA2PTPN1CA1
SCHEMBL19611303 0.93 PTGS1 (0.39) PTGS1PTGS2CA2PTPN1CA1
SCHEMBL2982251 0.87 PTGS1 (0.36) PTGS1PTGS2CA2PTPN11
SCHEMBL13266199 0.81 PTGS1 (0.44) PTGS1PTGS2CA2PTPN1PTPN11
Lithium SCHEMBL2991326 0.80 PTGS1 (0.43) PTGS1PTGS2CA2PTPN1PTPN11
SCHEMBL5017128 0.76 PTPN1 (0.37) PTGS1PTGS2CA2PTPN1MAPK1
SCHEMBL2992202 0.75 CA1 (0.35) PTGS1PTGS2CA2PTPN1SMN1; SMN2
SCHEMBL2994157 0.75 CA2 (0.47) CA2PTPN1SMN1; SMN2CA1PTPRZ1
SCHEMBL5013864 0.74 PTPN1 (0.38) PTGS1PTGS2CA2PTPN1MAPK1
SCHEMBL2989007 0.73 CA2 (0.41) PTGS1PTGS2CA2PTPN1PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853448-B2 Aromatic sulfonylimides, preparation thereof and use thereof as electrolyte INSTITUT NATIONAL POLYTECHNIQUE DE GRENOBLE (FR) 2014-10-07 US disclosed
US-20100174113-A1 AROMATIC SULPHONYLIMIDES, PREPARATION THEREOF AND USE THEREOF AS ELECTROLYTE INSTITUT NATIONAL POLYTECHNIQUE DE GRENOBLE (FR) 2010-07-08 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-20100174113-A1 AROMATIC SULPHONYLIMIDES, PREPARATION THEREOF AND USE THEREOF AS ELECTROLYTE AFF2, ARSA, FGFR2 PTGS1 4858/4885PTGS2 4527/4885CA2 173/4885

“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.