SCHEMBL30565846

SCHEMBL30565846

CC(F)S(=O)(=O)c1ccccn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
NFE2L2 Q16236 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 1/20 0.38
SLC40A1 Q9NP59 2/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
LOX P28300 1/20 0.37
GLO1 Q04760 1/20 0.37
KAT6A Q92794 1/20 0.37
RIPK1 Q13546 3/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
S1PR1 P21453 1/20 0.36
TSHR P16473 2/20 0.36
ABCC9 O60706 1/20 0.36

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
SCHEMBL28925088 0.85 KDM4E (0.41) KDM4EPKMNFE2L2L3MBTL1SLC40A1
SCHEMBL18322824 0.84 KDM4E (0.46) KDM4EPKMNFE2L2L3MBTL1POLB
SCHEMBL819454 0.84 KDM4E (0.46) KDM4EPKMNFE2L2L3MBTL1MEN1
SCHEMBL29707064 0.84 KDM4E (0.46) KDM4EPKMNFE2L2L3MBTL1POLB
SCHEMBL28647034 0.81 L3MBTL1 (0.40) KDM4EPKMNFE2L2L3MBTL1MEN1
SCHEMBL4004508 0.81 KDM4E (0.43) KDM4EPKMNFE2L2L3MBTL1MEN1
SCHEMBL30358629 0.81 KDM4E (0.43) KDM4EPKMNFE2L2L3MBTL1POLB
SCHEMBL30565867 0.81 PKM (0.47) KDM4EPKMNFE2L2L3MBTL1MEN1
Hydrochloric Acid SCHEMBL4005395 0.79 KDM4E (0.42) KDM4EPKMNFE2L2L3MBTL1MEN1
SCHEMBL24214151 0.78 ALOX5AP (0.43) KDM4EPKMNFE2L2L3MBTL1MEN1

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-116710467-A Photooxidation reduction protein modification 罗莎琳德·富兰克林研究所 2023-09-05 CN disclosed