SCHEMBL29668680

SCHEMBL29668680

COc1ccc(CN(c2nccs2)S(=O)(=O)c2cc(Cl)c(Br)cc2F)c(OC)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SCN1A P35498 10/20 0.35
SCN5A Q14524 9/20 0.35
SCN8A Q9UQD0 9/20 0.35
SCN9A Q15858 2/20 0.35
KDM4E B2RXH2 1/20 0.35
SCN2A Q99250 1/20 0.34
SCN3A Q9NY46 1/20 0.34
APLNR P35414 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
POLB P06746 1/20 0.33
ALOX12 P18054 1/20 0.33
HTR2A P28223 1/20 0.33
SLC6A4 P31645 1/20 0.33
KCNH2 Q12809 1/20 0.33
NR1I2 O75469 1/20 0.33
SCN1B Q07699 1/20 0.33

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
SCHEMBL20238943 1.00 MEN1 (0.36) MEN1KMT2ASCN1ASCN5ASCN8A
SCHEMBL16757120 0.94 MEN1 (0.37) MEN1KMT2ASCN1ASCN5ASCN8A
SCHEMBL16094553 0.92 MEN1 (0.38) MEN1KMT2ASCN1ASCN5ASCN8A
SCHEMBL29669214 0.91 MEN1 (0.36) MEN1KMT2ASCN1ASCN2ASCN3A
SCHEMBL20238225 0.91 MEN1 (0.36) MEN1KMT2ASCN1ASCN2ASCN3A
SCHEMBL16757041 0.90 MEN1 (0.38) MEN1KMT2ASCN1ASCN9AKDM4E
SCHEMBL20095491 0.90 TP53 (0.36) MEN1KMT2ASCN1ASCN5ASCN8A
SCHEMBL16771614 0.88 MEN1 (0.38) MEN1KMT2ASCN1ASCN5ASCN8A
SCHEMBL31566726 0.88 SCN1A (0.44) MEN1KMT2ASCN1ASCN5ASCN8A
SCHEMBL29668807 0.88 KDM4E (0.42) MEN1KMT2ASCN1ASCN9AKDM4E

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