SCHEMBL28283602

SCHEMBL28283602

NNc1cccc(S(=O)(=O)N2CCOCC2)c1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.59
ALDH1A1 P00352 5/20 0.59
MEN1 O00255 3/20 0.59
GAA P10253 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
LMNA P02545 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
ATM Q13315 1/20 0.58
MAPT P10636 2/20 0.58
EPHX2 P34913 1/20 0.57
HTT P42858 2/20 0.56
POLB P06746 2/20 0.56
TSHR P16473 1/20 0.56
RECQL P46063 1/20 0.56
CASP1 P29466 1/20 0.55
HSD17B10 Q99714 1/20 0.55
PKM P14618 1/20 0.55

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
SCHEMBL28283515 0.86 ALDH1A1 (0.65) KMT2AALDH1A1MEN1GAAL3MBTL1
SCHEMBL28285201 0.85 ALDH1A1 (0.68) KMT2AALDH1A1MEN1GAAL3MBTL1
SCHEMBL856792 0.83 PKM (0.66) KMT2AALDH1A1MEN1LMNAHTT
SCHEMBL29507905 0.83 PKM (0.66) KMT2AALDH1A1MEN1LMNAHTT
SCHEMBL6951550 0.83 GAA (0.69) KMT2AALDH1A1MEN1GAAL3MBTL1
SCHEMBL1592638 0.82 ALDH1A1 (0.63) KMT2AALDH1A1MEN1L3MBTL1TDP1
SCHEMBL28871030 0.82 POLB (0.59) KMT2AALDH1A1MEN1GAAL3MBTL1
Hydrochloric Acid SCHEMBL2544298 0.81 ALDH1A1 (0.62) KMT2AALDH1A1MEN1L3MBTL1TDP1
SCHEMBL20246801 0.81 KMT2A (0.60) KMT2AALDH1A1MEN1GAAL3MBTL1
SCHEMBL30023094 0.80 KMT2A (0.65) KMT2AALDH1A1MEN1GAAL3MBTL1

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-110015984-A Substituted (E)-N '-(1- phenylethylene) benzoyl hydrazine analog as histone demethylase inhibitor 犹他大学研究基金会 2019-07-16 CN disclosed
CN-105555784-B Substituted (E) -N' - (1-phenylethylene) benzoyl hydrazine analogs as histone demethylase inhibitors 犹他大学研究基金会 2019-03-15 CN disclosed