SCHEMBL29985647

SCHEMBL29985647

O=S(=O)(Nc1cc(Cl)c(Cl)c(Cl)c1)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.65
ALDH1A1 P00352 3/20 0.65
PKM P14618 2/20 0.65
ALOX15 P16050 2/20 0.65
HSD17B10 Q99714 2/20 0.65
HTT P42858 1/20 0.65
KEAP1 Q14145 2/20 0.62
IL1RN P18510 1/20 0.62
ERAP1 Q9NZ08 1/20 0.62
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
PGR P06401 3/20 0.57
CYTH2 Q99418 1/20 0.56
LMNA P02545 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HTR6 P50406 1/20 0.53
CYP19A1 P11511 1/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51

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
SCHEMBL1151729 0.86 GAA (0.80) GAAALDH1A1PKMALOX15HSD17B10
SCHEMBL5163794 0.84 LMNA (0.62) GAAALDH1A1PKMALOX15HSD17B10
SCHEMBL3789469 0.83 KEAP1 (0.64) GAAALDH1A1PKMALOX15HSD17B10
SCHEMBL2444333 0.83 KEAP1 (0.64) GAAALDH1A1PKMALOX15HSD17B10
SCHEMBL28557305 0.82 HTR6 (0.63) ALDH1A1HTTKEAP1MEN1KMT2A
SCHEMBL3781935 0.81 CRHBP (0.62) GAAALDH1A1PKMALOX15HSD17B10
SCHEMBL6478779 0.80 KEAP1 (0.60) GAAALDH1A1PKMALOX15HSD17B10
SCHEMBL8976245 0.80 PKM (0.67) GAAALDH1A1PKMALOX15HSD17B10
SCHEMBL19994885 0.80 LMNA (0.57) GAAALDH1A1PKMALOX15HSD17B10
SCHEMBL29498616 0.80 LMNA (0.57) GAAALDH1A1PKMALOX15HSD17B10

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-112851559-B FtsZ and QseC double-target antibacterial molecule and preparation method and application thereof 中国人民解放军空军军医大学 2022-11-08 CN disclosed