SCHEMBL11075713

SCHEMBL11075713

Cc1cccc(S(=O)(=O)n2cncn2)c1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.35
TSHR P16473 4/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPT P10636 3/20 0.33
MEN1 O00255 2/20 0.33
POLB P06746 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
THRB P10828 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP1A2 P05177 1/20 0.33
PKM P14618 1/20 0.33
CYP2C19 P33261 1/20 0.33
CYP19A1 P11511 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MAPK1 P28482 1/20 0.31
RAPGEF4 Q8WZA2 1/20 0.31

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
SCHEMBL4971615 0.81 CYP2C19 (0.37) KMT2ATSHRALDH1A1MAPTMEN1
SCHEMBL29394560 0.74 CA1 (0.44) MAPTPOLBL3MBTL1CYP19A1
SCHEMBL24254269 0.74 CA1 (0.44) MAPTPOLBL3MBTL1CYP19A1
SCHEMBL1826706 0.70 CA1 (0.46) KMT2AALDH1A1MAPTMEN1POLB
SCHEMBL7896751 0.67 KMT2A (0.47) KMT2ATSHRALDH1A1MAPTMEN1
SCHEMBL1538438 0.67 KMT2A (0.56) KMT2ATSHRALDH1A1MAPTKEAP1
SCHEMBL24254271 0.67 KMT2A (0.49) KMT2AALDH1A1MEN1POLBL3MBTL1
SCHEMBL3796970 0.66 KEAP1 (0.50) KMT2ATSHRALDH1A1MAPTKEAP1
SCHEMBL29604136 0.66 KEAP1 (0.50) KMT2ATSHRALDH1A1MAPTKEAP1
SCHEMBL330834 0.66 KMT2A (0.46) KMT2ATSHRALDH1A1MAPTMEN1

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
EP-0009998-B1 PEROXYGEN CONTAINING COMPOSITIONS AND BLEACHING PROCESS FMC Corporation (US) 1984-03-14 EP disclosed