SCHEMBL17048677

SCHEMBL17048677

O=S(=O)(Nc1nc(CCl)ns1)c1cc(F)c(F)cc1F

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.40
SCN9A Q15858 15/20 0.37
SCN2B O60939 2/20 0.36
SCN1B Q07699 2/20 0.36
SCN5A Q14524 5/20 0.35
SCN1A P35498 3/20 0.35
SCN8A Q9UQD0 3/20 0.35
CYP3A4 P08684 2/20 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
SCHEMBL17048667 0.79 SCN9A (0.50) HSD11B1SCN9ASCN2BSCN1BSCN5A
SCHEMBL17048644 0.78 ALDH1A1 (0.45) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL20238716 0.70 SCN9A (0.59) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL29669015 0.70 SCN9A (0.59) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL20449533 0.68 SCN9A (0.54) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL16177924 0.67 SCN8A (0.53) SCN9ASCN5ASCN1ASCN8ACYP3A4
SCHEMBL16177329 0.67 SCN5A (0.59) SCN9ASCN1BSCN5ASCN1ASCN8A
SCHEMBL5399886 0.67 MEP1B (0.43) SCN9A
SCHEMBL5831012 0.66 HSD11B1 (0.70) HSD11B1SCN1BSCN5ASCN1ASCN8A
SCHEMBL18882723 0.66 SCN9A (0.38) SCN9ASCN2BSCN1BSCN5ASCN1A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11236078-B2 Heterocyclic inhibitors of the sodium channel DeGiacomo, Mark G. (US) 2022-02-01 US disclosed
US-11236078-B2 Heterocyclic inhibitors of the sodium channel DeGiacomo, Mark G. (US) 2022-02-01 US disclosed
US-20170145003-A1 HETEROCYCLIC INHIBITORS OF THE SODIUM CHANNEL DeGiacomo, Mark G. (US) 2017-05-25 US disclosed
US-20170145003-A1 HETEROCYCLIC INHIBITORS OF THE SODIUM CHANNEL DeGiacomo, Mark G. (US) 2017-05-25 US disclosed
US-20170145003-A1 HETEROCYCLIC INHIBITORS OF THE SODIUM CHANNEL DeGiacomo, Mark G. (US) 2017-05-25 US disclosed
WO-2015130957-A1 HETEROCYCLIC INHIBITORS OF THE SODIUM CHANNEL Zalicus Pharmaceuticals, Ltd. (US) 2015-09-03 WO disclosed
WO-2015130957-A1 HETEROCYCLIC INHIBITORS OF THE SODIUM CHANNEL Zalicus Pharmaceuticals, Ltd. (US) 2015-09-03 WO 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-20170145003-A1 HETEROCYCLIC INHIBITORS OF THE SODIUM CHANNEL SCN1B, SCN1A, CACNA1S HSD11B1 2329/4885SCN9A 29/4885SCN2B 15/4885
US-11236078-B2 Heterocyclic inhibitors of the sodium channel SCN1B, TRPM6, SCN1A HSD11B1 2682/4885SCN9A 32/4885SCN2B 13/4885

“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.