SCHEMBL21773271

SCHEMBL21773271

COc1ccc(CN(c2cscn2)S(=O)(=O)c2cc(C)c(N(C)C3C[C@H]4CC[C@@H](C3)N4C(=O)O)cn2)cc1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 17/20 0.42
SCN1A P35498 15/20 0.42
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
MMP9 P14780 1/20 0.35
MMP12 P39900 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
SCHEMBL21773267 1.00 SCN8A (0.42) SCN8ASCN1AKEAP1NFE2L2MMP9
SCHEMBL21773268 1.00 SCN8A (0.42) SCN8ASCN1AKEAP1NFE2L2MMP9
SCHEMBL21789154 0.91 SCN8A (0.40) SCN8ASCN1A
SCHEMBL30845699 0.91 SCN8A (0.40) SCN8ASCN1A
SCHEMBL21773229 0.87 SCN8A (0.47) SCN8ASCN1A
SCHEMBL21773225 0.87 SCN8A (0.47) SCN8ASCN1A
SCHEMBL21773278 0.86 MMP9 (0.36) SCN8ASCN1AKEAP1NFE2L2MMP9
SCHEMBL21773280 0.86 MMP9 (0.36) SCN8ASCN1AKEAP1NFE2L2MMP9
SCHEMBL21773285 0.86 MMP9 (0.36) SCN8ASCN1AKEAP1NFE2L2MMP9
SCHEMBL21789506 0.81 SCN8A (0.43) SCN8ASCN1A

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-10752623-B2 Heteroaryl-substituted sulfonamide compounds and their use as sodium channel inhibitors XENON PHARMACEUTICALS INC. (CA) 2020-08-25 US disclosed
US-20200071313-A1 HETEROARYL-SUBSTITUTED SULFONAMIDE COMPOUNDS AND THEIR USE AS SODIUM CHANNEL INHIBITORS XENON PHARMACEUTICALS INC. (CA) 2020-03-05 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 (2 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-20200071313-A1 HETEROARYL-SUBSTITUTED SULFONAMIDE COMPOUNDS AND THEIR USE AS SODIUM CHANNEL INHIBITORS SCN1A, SCN2A, SCN2B SCN8A 6/4885SCN1A 1/4885KEAP1 2773/4885
US-10752623-B2 Heteroaryl-substituted sulfonamide compounds and their use as sodium channel inhibitors SCN1A, SCN2A, SCN2B SCN8A 6/4885SCN1A 1/4885KEAP1 2773/4885

“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.