SCHEMBL29028384

SCHEMBL29028384

CCCCCCCNS(=O)(=O)c1ccc(F)c(F)c1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.62
HTT P42858 2/20 0.62
MAPK1 P28482 1/20 0.62
ALDH1A1 P00352 6/20 0.57
PKM P14618 5/20 0.57
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
PDK1 Q15118 2/20 0.50
PDK2 Q15119 2/20 0.50
PDK3 Q15120 2/20 0.50
PDK4 Q16654 2/20 0.50
RECQL P46063 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
KDM4E B2RXH2 1/20 0.47
PKLR P30613 2/20 0.47
TSHR P16473 1/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL5020896 0.81 ALDH1A1 (0.80) LMNAHTTMAPK1ALDH1A1PKM
SCHEMBL28830609 0.81 KMT2A (0.51) HTTALDH1A1PKMKMT2AMEN1
SCHEMBL14488016 0.80 LMNA (0.58) LMNAHTTMAPK1ALDH1A1KMT2A
SCHEMBL17430764 0.80 MAPK1 (0.63) LMNAHTTMAPK1ALDH1A1PKM
SCHEMBL27278034 0.80 MEN1 (0.59) LMNAHTTMAPK1ALDH1A1PKM
SCHEMBL13286997 0.79 LMNA (0.62) LMNAHTTMAPK1ALDH1A1PKM
SCHEMBL9942078 0.78 NPY1R (0.67) LMNAHTTMAPK1ALDH1A1SMN1; SMN2
SCHEMBL15832926 0.78 PKM (0.47) LMNAALDH1A1PKMKMT2AMEN1
SCHEMBL13314764 0.78 TSHR (0.61) LMNAHTTMAPK1ALDH1A1PKM
SCHEMBL7130425 0.78 ALDH1A1 (0.60) LMNAHTTMAPK1ALDH1A1PKM

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-115974732-A Method for preparing alkyl sulfonyl fluoride 中国石油大学(华东) 2023-04-18 CN disclosed