SCHEMBL28113726

SCHEMBL28113726

Nc1ccc(S(=O)(=O)NCc2cccs2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.68
POLB P06746 3/20 0.68
TDP1 Q9NUW8 1/20 0.68
CYP2C19 P33261 1/20 0.57
NSD2 O96028 1/20 0.56
LMNA P02545 4/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
USP2 O75604 1/20 0.54
MAPT P10636 1/20 0.54
HTT P42858 1/20 0.54
MAPK1 P28482 1/20 0.53
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA4 P22748 1/20 0.53
CA6 P23280 1/20 0.53
CA5A P35218 1/20 0.53
CA7 P43166 1/20 0.53
CA9 Q16790 1/20 0.53

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
SCHEMBL1874186 0.85 ALDH1A1 (0.68) ALDH1A1POLBTDP1LMNAMEN1
SCHEMBL11887767 0.84 KMT2A (0.68) ALDH1A1POLBTDP1LMNAMEN1
SCHEMBL28003774 0.84 ALDH1A1 (0.72) ALDH1A1POLBTDP1LMNAMEN1
SCHEMBL12793685 0.84 ALDH1A1 (0.72) ALDH1A1POLBTDP1LMNAMEN1
SCHEMBL14484120 0.83 ALDH1A1 (0.66) ALDH1A1POLBTDP1LMNAMEN1
SCHEMBL3562140 0.82 ALDH1A1 (0.64) ALDH1A1POLBTDP1NSD2LMNA
SCHEMBL8324532 0.82 ALDH1A1 (0.64) ALDH1A1POLBTDP1LMNAMEN1
SCHEMBL13712056 0.82 ALDH1A1 (0.64) ALDH1A1POLBTDP1NSD2LMNA
SCHEMBL10288218 0.81 POLB (0.63) ALDH1A1POLBTDP1CYP2C19LMNA
SCHEMBL28727053 0.81 ALDH1A1 (0.63) ALDH1A1POLBTDP1LMNAKMT2A

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-106146358-B Method for synthesizing amino- (N-alkyl) benzene sulfonamide 南京理工大学 2018-01-23 CN disclosed
CN-106146358-A Method for synthesizing amino- (N-alkyl) benzene sulfonamide 南京理工大学 2016-11-23 CN disclosed