SCHEMBL2989007

SCHEMBL2989007

O=S(=O)(NS(=O)(=O)C(F)(F)C(F)(F)S(=O)(=O)c1ccccc1)C(F)(F)F.[LiH]

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.41
PTGS1 P23219 3/20 0.36
PTGS2 P35354 3/20 0.36
IL1RN P18510 1/20 0.36
KEAP1 Q14145 1/20 0.36
ERAP1 Q9NZ08 1/20 0.36
NR1H3 Q13133 1/20 0.36
PTPN1 P18031 1/20 0.35
KIF11 P52732 1/20 0.35
CA1 P00915 2/20 0.35
HTR6 P50406 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PKM P14618 1/20 0.34
KMT2A Q03164 1/20 0.34
PTPN11 Q06124 1/20 0.34

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
SCHEMBL2991758 0.84 CA2 (0.41) CA2PTGS1PTGS2IL1RNKEAP1
SCHEMBL13266257 0.82 CA2 (0.42) CA2PTGS1PTGS2IL1RNKEAP1
SCHEMBL11559001 0.79 KEAP1 (0.48) CA2IL1RNKEAP1ERAP1NR1H3
SCHEMBL17266478 0.79 PTPN1 (0.49) CA2PTGS1PTGS2IL1RNKEAP1
SCHEMBL776228 0.77 HTR6 (0.46) CA2IL1RNKEAP1ERAP1NR1H3
SCHEMBL18535392 0.76 CA1 (0.48) CA2IL1RNKEAP1ERAP1NR1H3
SCHEMBL120712 0.76 CA2 (0.48) CA2IL1RNKEAP1ERAP1NR1H3
SCHEMBL2993840 0.74 HTR6 (0.42) CA2IL1RNKEAP1ERAP1NR1H3
SCHEMBL2991879 0.73 PTGS1 (0.42) CA2PTGS1PTGS2PTPN1CA1
SCHEMBL2988092 0.73 KEAP1 (0.54) CA2KEAP1CA1ALDH1A1KMT2A

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 CA2 173/4885PTGS1 4858/4885PTGS2 4527/4885

“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.