SCHEMBL17048546

SCHEMBL17048546

COc1ccc(CN(c2nncs2)S(=O)(=O)c2ccc(F)cc2)c(OC)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
SCN9A Q15858 2/20 0.40
TSHR P16473 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KEAP1 Q14145 4/20 0.39
NFE2L2 Q16236 4/20 0.39
TAS2R14 Q9NYV8 2/20 0.38
CYP1A1 P04798 1/20 0.38
CYP1B1 Q16678 1/20 0.38
MAPT P10636 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
SCHEMBL320928 0.88 SOS1 (0.38) MEN1KMT2ASCN9ATSHRNPC1
SCHEMBL14921743 0.86 SMN1; SMN2 (0.39) MEN1KMT2ATSHRNPC1RAB9A
SCHEMBL322245 0.85 SLC22A12 (0.41) MEN1KMT2ASCN9ATSHRNPC1
SCHEMBL17048560 0.85 BMP1 (0.37) MEN1KMT2ASCN9ATSHRNPC1
SCHEMBL29668838 0.84 KEAP1 (0.41) MEN1KMT2ASCN9ANPC1RAB9A
SCHEMBL17048628 0.84 KEAP1 (0.41) MEN1KMT2ASCN9ANPC1RAB9A
SCHEMBL1095453 0.83 SMN1; SMN2 (0.37) MEN1KMT2ASCN9ATSHRNPC1
SCHEMBL319860 0.83 NPC1 (0.39) MEN1KMT2ASCN9ATSHRNPC1
SCHEMBL18882667 0.83 SCN9A (0.37) MEN1KMT2ASCN9ATSHRNPC1
SCHEMBL17048645 0.82 SCN9A (0.49) MEN1KMT2ASCN9ASMN1; SMN2KEAP1

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 MEN1 374/4885KMT2A 3063/4885SCN9A 29/4885
US-11236078-B2 Heterocyclic inhibitors of the sodium channel SCN1B, TRPM6, SCN1A MEN1 427/4885KMT2A 3328/4885SCN9A 32/4885

“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.