SCHEMBL27884380

SCHEMBL27884380

Nc1ccc(S(=O)(=O)Nc2ccc(CC(=O)O)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.61
KEAP1 Q14145 1/20 0.61
MEN1 O00255 2/20 0.61
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
HTT P42858 1/20 0.59
CA9 Q16790 1/20 0.59
CASP6 P55212 1/20 0.58
HDAC1 Q13547 1/20 0.57
HDAC8 Q9BY41 1/20 0.57
CYP26A1 O43174 1/20 0.56
CYP26B1 Q9NR63 1/20 0.56
GAA P10253 1/20 0.56
ALDH1A1 P00352 4/20 0.55
POLB P06746 1/20 0.55
KDM4E B2RXH2 1/20 0.55
PRMT1 Q99873 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
MAPT P10636 1/20 0.54

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
SCHEMBL5205017 0.86 HDAC1 (0.75) KMT2AKEAP1MEN1CASP6HDAC1
SCHEMBL27889027 0.86 ALDH1A1 (0.67) KMT2AKEAP1MEN1CA1CA2
SCHEMBL8074277 0.85 ALDH1A1 (0.74) KMT2AMEN1CA1CA2CA9
SCHEMBL31681345 0.82 ALDH1A1 (0.63) CASP6HDAC1HDAC8CYP26A1CYP26B1
SCHEMBL4616444 0.82 KMT2A (0.66) KMT2AMEN1HTTCASP6HDAC1
SCHEMBL11793140 0.82 CA1 (0.85) KMT2AKEAP1MEN1CA1CA2
SCHEMBL540915 0.82 CA1 (0.85) KMT2AKEAP1MEN1CA1CA2
SCHEMBL5446391 0.81 L3MBTL1 (0.67) CASP6HDAC1HDAC8CYP26A1CYP26B1
SCHEMBL11685957 0.80 CA1 (0.61) KMT2AKEAP1MEN1CA1CA2
SCHEMBL7122971 0.80 UCHL1 (0.76) KMT2AKEAP1MEN1CA1CA2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102627624-B 4-(4-aminobenzene sulfonamide) phenylacetic acid derivative and preparation method and application thereof UNIV SOUTHWEST 2014-03-19 CN disclosed
CN-102627624-B 4-(4-aminobenzene sulfonamide) phenylacetic acid derivative and preparation method and application thereof UNIV SOUTHWEST 2014-03-19 CN disclosed
CN-102627624-A 4-(4-aminobenzene sulfonamide) phenylacetic acid derivative and preparation method and application thereof UNIV SOUTHWEST 2012-08-08 CN disclosed
CN-102627624-A 4-(4-aminobenzene sulfonamide) phenylacetic acid derivative and preparation method and application thereof UNIV SOUTHWEST 2012-08-08 CN disclosed