SCHEMBL21708362

SCHEMBL21708362

COc1ccc(NS(=O)(=O)c2ccc(F)cc2)c([N+](=O)[O-])c1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.58
MAPT P10636 4/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
TDP1 Q9NUW8 3/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
HTT P42858 1/20 0.57
MCOLN3 Q8TDD5 1/20 0.57
ALDH1A1 P00352 4/20 0.54
POLB P06746 1/20 0.54
STAT3 P40763 1/20 0.54
ALDH3A1 P30838 2/20 0.52
FFAR4 Q5NUL3 2/20 0.51
RAB9A P51151 1/20 0.51
KEAP1 Q14145 2/20 0.50
NFE2L2 Q16236 2/20 0.50
SQSTM1 Q13501 1/20 0.50
FBP1 P09467 1/20 0.49

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
SCHEMBL21708265 0.92 MAPT (0.62) LMNAMAPTMEN1KMT2ATDP1
SCHEMBL8752415 0.88 MAPT (0.65) LMNAMAPTMEN1KMT2ATDP1
SCHEMBL29470853 0.88 MAPT (0.65) LMNAMAPTMEN1KMT2ATDP1
SCHEMBL6831954 0.88 MAPT (0.71) LMNAMAPTMEN1KMT2ATDP1
SCHEMBL21708219 0.88 MAPT (0.54) LMNAMAPTMEN1KMT2ATDP1
Water SCHEMBL29037310 0.85 MAPT (0.61) LMNAMAPTMEN1KMT2ATDP1
SCHEMBL21708243 0.85 KEAP1 (0.65) LMNAMAPTMEN1KMT2ATDP1
SCHEMBL7571563 0.84 STAT3 (0.61) LMNAKMT2ASMN1; SMN2HTTALDH1A1
SCHEMBL28702766 0.83 PGR (0.60) LMNAMAPTMEN1KMT2ATDP1
SCHEMBL2008393 0.83 MAPT (0.60) LMNAMAPTMEN1KMT2ATDP1

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-20210107871-A1 BIARYL SULFONAMIDE DERIVATIVE HAVING FILOVIRUS CELL ENTRY INHIBITION ACTIVITY NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2021-04-15 US disclosed
EP-3611161-A1 BIARYL SULFONAMIDE DERIVATIVE HAVING FILOVIRUS CELL ENTRY INHIBITION ACTIVITY National University Corporation Hokkaido University (JP) 2020-02-19 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-20210107871-A1 BIARYL SULFONAMIDE DERIVATIVE HAVING FILOVIRUS CELL ENTRY INHIBITION ACTIVITY FLNA, FLNB, BRI3BP LMNA 970/4885MAPT 2599/4885MEN1 4456/4885

“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.