SCHEMBL21708239

SCHEMBL21708239

COc1ccc(N(CCCN(C(=O)O)C(C)(C)C)S(=O)(=O)c2ccccc2)c(-c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 13/20 0.54
NFE2L2 Q16236 13/20 0.54
BMP1 P13497 1/20 0.42
MAPT P10636 1/20 0.41
MMP1 P03956 1/20 0.41
MMP9 P14780 1/20 0.41
MMP13 P45452 1/20 0.41
CAMK2A Q9UQM7 1/20 0.41

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
SCHEMBL21708227 0.84 KEAP1 (0.55) KEAP1NFE2L2BMP1MAPT
SCHEMBL21708285 0.84 KEAP1 (0.52) KEAP1NFE2L2BMP1MAPTCAMK2A
SCHEMBL21708276 0.83 KEAP1 (0.53) KEAP1NFE2L2BMP1
SCHEMBL21708233 0.82 KEAP1 (0.55) KEAP1NFE2L2BMP1MAPTCAMK2A
SCHEMBL23228844 0.81 KEAP1 (0.51) KEAP1NFE2L2BMP1MAPT
SCHEMBL21708240 0.81 KEAP1 (0.53) KEAP1NFE2L2BMP1MAPTMMP1
SCHEMBL21708282 0.81 KEAP1 (0.56) KEAP1NFE2L2BMP1MAPT
SCHEMBL21734441 0.81 KEAP1 (0.50) KEAP1NFE2L2BMP1MAPT
SCHEMBL21708332 0.80 KEAP1 (0.57) KEAP1NFE2L2MAPT
SCHEMBL21734725 0.79 KEAP1 (0.60) KEAP1NFE2L2MAPT

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 4 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 claimed
EP-3611161-A1 BIARYL SULFONAMIDE DERIVATIVE HAVING FILOVIRUS CELL ENTRY INHIBITION ACTIVITY National University Corporation Hokkaido University (JP) 2020-02-19 EP claimed
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 KEAP1 3844/4885NFE2L2 3888/4885BMP1 4720/4885

“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.