SCHEMBL29816630

SCHEMBL29816630

CN(C)C=NS(=O)(=O)c1ccccc1F

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
GAA P10253 1/20 0.49
BCAT1 P54687 1/20 0.39
KMT2A Q03164 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
HSD17B10 Q99714 1/20 0.37
NFE2L2 Q16236 4/20 0.36
KAT6A Q92794 2/20 0.36
KCNA5 P22460 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD11B1 P28845 1/20 0.35

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
SCHEMBL489291 0.79 LMNA (0.49) LMNAGAABCAT1KMT2ATDP1
SCHEMBL8096686 0.79 LMNA (0.49) LMNAGAABCAT1KMT2AALDH1A1
SCHEMBL10530946 0.79 LMNA (0.49) LMNAGAABCAT1KMT2ATDP1
SCHEMBL7534420 0.74 GAA (0.44) LMNAGAABCAT1KMT2AHSD17B10
SCHEMBL7534421 0.74 GAA (0.44) LMNAGAABCAT1KMT2AHSD17B10
SCHEMBL4110091 0.74 LMNA (0.70) LMNAGAABCAT1KMT2AALDH1A1
SCHEMBL4972178 0.74 LMNA (0.70) LMNAGAABCAT1KMT2AALDH1A1
SCHEMBL489379 0.73 LMNA (0.58) LMNAGAABCAT1KMT2AALDH1A1
SCHEMBL6232240 0.73 GAA (0.67) LMNAGAABCAT1ALDH1A1
SCHEMBL7262048 0.73 GAA (0.67) LMNAGAABCAT1ALDH1A1

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-114940657-A Amidine compound synthesized from N, N, N ', N' -tetramethylethylenediamine 三峡大学 2022-08-26 CN disclosed