SCHEMBL29155271

SCHEMBL29155271

CC(C)c1ccc(S(=O)(=O)Oc2cccc(N)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.46
TDP1 Q9NUW8 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 1/20 0.46
GAA P10253 2/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 5/20 0.42
CYP3A4 P08684 2/20 0.42
CA1 P00915 3/20 0.40
CA2 P00918 3/20 0.40
CA9 Q16790 3/20 0.40
TP53 P04637 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
HTR6 P50406 1/20 0.38
MAOB P27338 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL19470809 0.88 HTR6 (0.47) LMNATDP1L3MBTL1SMN1; SMN2HTT
SCHEMBL6470176 0.83 ALDH1A1 (0.52) LMNATDP1L3MBTL1SMN1; SMN2HTT
SCHEMBL11309927 0.82 LMNA (0.63) LMNATDP1L3MBTL1SMN1; SMN2HTT
SCHEMBL14162936 0.81 TDP1 (0.56) LMNATDP1L3MBTL1SMN1; SMN2HTT
SCHEMBL29673592 0.81 ALDH1A1 (0.55) LMNATDP1L3MBTL1SMN1; SMN2HTT
SCHEMBL6666074 0.81 ALDH1A1 (0.55) LMNATDP1L3MBTL1SMN1; SMN2HTT
SCHEMBL11081800 0.81 TDP1 (0.47) LMNATDP1L3MBTL1SMN1; SMN2HTT
SCHEMBL27357814 0.80 TDP1 (0.54) LMNATDP1L3MBTL1SMN1; SMN2HTT
SCHEMBL19834314 0.79 LMNA (0.57) LMNATDP1L3MBTL1SMN1; SMN2HTT
SCHEMBL29155254 0.79 GPR17 (0.56)

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-117511247-A Disperse dye ink dispersing agent and application thereof 沈阳化工研究院有限公司 2024-02-06 CN disclosed