SCHEMBL29669052

SCHEMBL29669052

COc1ccc(CN(c2ncns2)S(=O)(=O)c2c(F)cc(NCc3ccccc3CN3CCC3)c(C)c2F)c(OC)c1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 17/20 0.61
SCN5A Q14524 17/20 0.61
SCN8A Q9UQD0 17/20 0.61
CD274 Q9NZQ7 1/20 0.37
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 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
SCHEMBL20237892 1.00 SCN1A (0.61) SCN1ASCN5ASCN8ACD274KDM4E
SCHEMBL20252707 0.94 SCN1A (0.60) SCN1ASCN5ASCN8A
SCHEMBL20238068 0.93 SCN1A (0.61) SCN1ASCN5ASCN8AKDM4ELMNA
SCHEMBL29669228 0.93 SCN1A (0.52) SCN1ASCN5ASCN8AKDM4ELMNA
SCHEMBL29668646 0.93 SCN1A (0.61) SCN1ASCN5ASCN8AKDM4ELMNA
SCHEMBL20237911 0.93 SCN1A (0.52) SCN1ASCN5ASCN8AKDM4ELMNA
SCHEMBL20252701 0.87 SCN1A (0.61) SCN1ASCN5ASCN8A
SCHEMBL20252706 0.87 SCN1A (0.52) SCN1ASCN5ASCN8A
SCHEMBL29669085 0.87 SCN1A (0.50) SCN1ASCN5ASCN8ACD274KDM4E
SCHEMBL28740380 0.87 SCN1A (0.50) SCN1ASCN5ASCN8ACD274KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110325531-B Benzenesulfonamides and their use as therapeutic agents 泽农医药公司 2022-05-27 CN disclosed