SCHEMBL23617255

SCHEMBL23617255

CN1CC[C@@H](c2ccc(Br)s2)NS1(=O)=O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
HTT P42858 1/20 0.35
LMNA P02545 3/20 0.34
TSHR P16473 2/20 0.34
MAPK1 P28482 1/20 0.34
TDP1 Q9NUW8 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ABCC9 O60706 1/20 0.33
ABCC8 Q09428 1/20 0.33
KCNJ11 Q14654 1/20 0.33
KCNJ8 Q15842 1/20 0.33
ALDH1A1 P00352 3/20 0.32
HPGD P15428 1/20 0.30
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
MCL1 Q07820 1/20 0.30

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
SCHEMBL23617463 0.85 ALDH1A1 (0.38) MAPTLMNAMAPK1KDM4EALDH1A1
SCHEMBL23617464 0.78 ALDH1A1 (0.44) MAPTLMNAMAPK1KDM4EALDH1A1
SCHEMBL23617291 0.77 CYP2E1 (0.35)
SCHEMBL23617669 0.77 GRIN1 (0.31) MAPK1
SCHEMBL23617616 0.76 IDO1 (0.32)
SCHEMBL23617814 0.76 KDM4E (0.42) MAPTKDM4EALDH1A1GAARAB9A
SCHEMBL23617482 0.76 AKT1 (0.36)
SCHEMBL23617674 0.75
SCHEMBL23617592 0.75 CYP2A6 (0.42)
SCHEMBL23617596 0.74 KDM4E (0.34) KDM4EALDH1A1MEN1KMT2A

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
EP-3589630-B1 CYCLIC SULFAMIDE COMPOUNDS AND METHODS OF USING SAME ASSEMBLY BIOSCIENCES INC (US) 2021-07-07 EP disclosed