SCHEMBL23617441

SCHEMBL23617441

CN1CC[C@@H](c2ccc(F)cc2)NS1(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.36
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
ATM Q13315 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
GRIA1 P42261 1/20 0.34
GRIA2 P42262 1/20 0.34
GRIA3 P42263 1/20 0.34
GRIA4 P48058 1/20 0.34
TRPA1 O75762 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
SCHEMBL23617235 0.84 SRD5A1 (0.41)
SCHEMBL3652840 0.84 CHRNB2 (0.39)
SCHEMBL23617234 0.74 DRD2 (0.47) HTR2AHTR2CKDM4EALDH1A1HSD17B10
SCHEMBL22022123 0.73 HRH3 (0.43) KCNH2HTR2AHTR2CKDM4EALDH1A1
SCHEMBL23617571 0.72 DDB1 (0.40) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL28297380 0.71 KCNH2 (0.37) KCNH2ATMKDM4EALDH1A1HPGD
SCHEMBL23617463 0.71 ALDH1A1 (0.38) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL23617414 0.70 HCAR2 (0.34) GAA
SCHEMBL23617454 0.69
SCHEMBL23617255 0.69 MAPT (0.35) KDM4EALDH1A1HPGDGAAMAPT

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