SCHEMBL21708286

SCHEMBL21708286

COc1ccc(N(CC2CCNCC2)S(=O)(=O)c2ccccc2)c(-c2cccc(F)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 6/20 0.44
NFE2L2 Q16236 6/20 0.44
LMNA P02545 1/20 0.40
CHRM1 P11229 2/20 0.39
CHRM3 P20309 2/20 0.38
CHRM2 P08172 1/20 0.38
MAPT P10636 1/20 0.37
PGR P06401 1/20 0.37
HTR6 P50406 1/20 0.37
TAS2R14 Q9NYV8 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KCNA5 P22460 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL21708263 0.95 KEAP1 (0.44) KEAP1NFE2L2LMNACHRM1CHRM3
SCHEMBL21708324 0.92 KEAP1 (0.51) KEAP1NFE2L2LMNAMAPTMEN1
SCHEMBL21708350 0.91 KEAP1 (0.45) KEAP1NFE2L2LMNACHRM1CHRM3
SCHEMBL21708277 0.91 KEAP1 (0.49) KEAP1NFE2L2LMNACHRM1CHRM3
SCHEMBL21708321 0.87 KEAP1 (0.42) KEAP1NFE2L2LMNAPGRHTR6
SCHEMBL21708343 0.86 LMNA (0.41) KEAP1NFE2L2LMNACHRM1MAPT
SCHEMBL21708302 0.84 CHRM1 (0.42) KEAP1NFE2L2CHRM1CHRM3CHRM2
SCHEMBL21708359 0.82 KEAP1 (0.43) KEAP1NFE2L2LMNAMAPTMEN1
SCHEMBL21708319 0.82 SMN1; SMN2 (0.42) KEAP1NFE2L2MAPTPGRHTR6
SCHEMBL21708283 0.81 KEAP1 (0.48) KEAP1NFE2L2LMNASMN1; SMN2

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 disclosed
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
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 3888/4885LMNA 970/4885

“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.