SCHEMBL29464484

SCHEMBL29464484

Cc1c(C#N)cccc1-c1nc(NS(=O)(=O)c2cccc(N)n2)ccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.40
ADORA2A P29274 4/20 0.36
SLC22A12 Q96S37 6/20 0.35
SCN9A Q15858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
USP8 P40818 1/20 0.33
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 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
SCHEMBL19927805 1.00 HSD11B1 (0.40) HSD11B1ADORA2ASLC22A12SCN9AL3MBTL1
SCHEMBL29464317 0.91 HSD11B1 (0.42) HSD11B1SLC22A12SCN9AHSP90AA1HSP90AB1
SCHEMBL19925025 0.91 HSD11B1 (0.42) HSD11B1SLC22A12SCN9AHSP90AA1HSP90AB1
SCHEMBL29464516 0.84 HSD11B1 (0.38) HSD11B1SCN9AL3MBTL1
SCHEMBL19928762 0.84 HSD11B1 (0.38) HSD11B1SCN9AL3MBTL1
SCHEMBL19925022 0.84 SCN9A (0.42) SLC22A12SCN9A
SCHEMBL29464358 0.84 SCN9A (0.42) SLC22A12SCN9A
SCHEMBL29464324 0.83 HSD11B1 (0.38) HSD11B1ADORA2ASCN9AL3MBTL1
SCHEMBL19968754 0.83 HSD11B1 (0.38) HSD11B1ADORA2ASCN9AL3MBTL1
SCHEMBL19925179 0.82 HSD11B1 (0.46) HSD11B1SLC22A12SCN9A

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-109641873-B N- (pyridin-2-yl) pyridine-sulfonamide derivatives and their use for the treatment of disease 诺华股份有限公司 2022-03-18 CN claimed
CN-109641873-B N- (pyridin-2-yl) pyridine-sulfonamide derivatives and their use for the treatment of disease 诺华股份有限公司 2022-03-18 CN disclosed