SCHEMBL21865565

SCHEMBL21865565

COc1ccc(CN(c2ncns2)S(=O)(=O)c2cc(F)c(N)cc2F)c(OC)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 4/20 0.40
TP53 P04637 1/20 0.38
POLB P06746 2/20 0.35
MAPK1 P28482 1/20 0.34
GFER P55789 1/20 0.34
DHFR P00374 1/20 0.34
GAA P10253 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HDAC8 Q9BY41 1/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
RORC P51449 1/20 0.32
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
JAK3 P52333 1/20 0.32
CA2 P00918 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL29835251 0.92 SCN9A (0.42) SCN9ATP53POLBGAAMEN1
SCHEMBL1094096 0.92 SCN9A (0.42) SCN9ATP53POLBGAAMEN1
SCHEMBL28548900 0.92 SCN9A (0.39) SCN9ATP53POLBMAPK1DHFR
SCHEMBL29835222 0.90 SCN9A (0.40) SCN9ATP53POLBMAPK1GFER
SCHEMBL21865388 0.90 SCN9A (0.40) SCN9ATP53POLBMAPK1GFER
SCHEMBL20115730 0.89 SCN9A (0.40) SCN9ATP53POLBGAAMEN1
SCHEMBL29835279 0.89 SCN9A (0.40) SCN9ATP53POLBGAAMEN1
SCHEMBL20449461 0.89 SCN9A (0.40) SCN9ATP53POLBGAAMEN1
SCHEMBL30479338 0.89 SCN9A (0.40) SCN9ATP53POLBGAAMEN1
SCHEMBL9924609 0.88 SCN9A (0.41) SCN9ATP53POLBMAPK1GAA

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
CN-110885319-B Sulfonamide compounds as sodium channel blockers and uses thereof 成都康弘药业集团股份有限公司 2022-08-12 CN disclosed
WO-2020052509-A1 SULFONAMIDE COMPOUND SERVING AS SODIUM CHANNEL BLOCKER AND USES THEREOF 成都康弘药业集团股份有限公司 2020-03-19 WO disclosed