SCHEMBL5317016

SCHEMBL5317016

CCN(C)CC.Cc1ccccc1S(=O)(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
RAPGEF4 Q8WZA2 1/20 0.44
HCRTR2 O43614 1/20 0.43
MYC P01106 1/20 0.42
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
NSD2 O96028 1/20 0.38
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
RECQL P46063 1/20 0.38
MAPT P10636 2/20 0.38
ALDH1A1 P00352 3/20 0.38
TP53 P04637 1/20 0.36
SUMO2 P61956 1/20 0.36
SUMO1 P63165 1/20 0.36
SENP7 Q9BQF6 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
SCHEMBL3130640 0.87 KMT2A (0.48) KMT2ARAPGEF4HCRTR2MYCTDP1
Trimethylammonium SCHEMBL6671555 0.87 MYC (0.48) KMT2ARAPGEF4HCRTR2MYCHTR2A
Alcohol SCHEMBL27960969 0.85 RAPGEF4 (0.49) KMT2ARAPGEF4HCRTR2MYCL3MBTL1
SCHEMBL7859160 0.85 RAPGEF4 (0.49) KMT2ARAPGEF4HCRTR2MYCL3MBTL1
SCHEMBL29392580 0.84 MYC (0.53) KMT2ARAPGEF4MYCTDP1L3MBTL1
SCHEMBL1748 0.84 MYC (0.53) KMT2ARAPGEF4MYCTDP1L3MBTL1
Ethyl Chloride SCHEMBL9370368 0.83 RAPGEF4 (0.47) KMT2ARAPGEF4HCRTR2MYCL3MBTL1
Alcohol SCHEMBL28156310 0.83 RAPGEF4 (0.47) KMT2ARAPGEF4HCRTR2MYCL3MBTL1
Ethylamine SCHEMBL7984887 0.83 RAPGEF4 (0.47) KMT2ARAPGEF4HCRTR2MYCL3MBTL1
SCHEMBL5372943 0.83 KMT2A (0.44) KMT2ARAPGEF4HCRTR2MYCTDP1

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
WO-2007081057-A1 CURABLE COMPOSITION AND CURED PRODUCT, LAMINATE FILM AND ANTIREFLECTIVE FILM USING THE SAME AND POLARIZING PLATE AND IMAGE DISPLAY DEVICE USING THE ANTIREFLECTIVE FILM FUJIFILM CORPORATION (JP) 2007-07-19 WO disclosed