SCHEMBL28349910

SCHEMBL28349910

O=Cc1ccccc1OS(=O)(=O)O.[NaH]

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.61
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
SRC P12931 3/20 0.50
LMNA P02545 4/20 0.48
KMT2A Q03164 2/20 0.48
GAA P10253 1/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.47
MEN1 O00255 1/20 0.44
THRB P10828 1/20 0.44
BLM P54132 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
TRIM24 O15164 1/20 0.42
TRIM33 Q9UPN9 1/20 0.42

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
SCHEMBL5024306 0.98 ALDH1A1 (0.62) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL11585504 0.96 ALDH1A1 (0.61) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL7614002 0.91 ALDH1A1 (0.56) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL9543056 0.85 SRC (0.76) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL28986963 0.83 ALDH1A1 (0.42) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL731975 0.81 ALDH1A1 (0.43) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL29743115 0.81 ALDH1A1 (0.43) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL15398866 0.80 ALDH1A1 (0.44) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL15398867 0.80 ALDH1A1 (0.44) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL514247 0.79 SLC22A6 (0.53) ALDH1A1HTTSMN1; SMN2LMNASLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110627737-B Water-soluble benzoxazole fluorescent probe for detecting zinc ions as well as preparation method and application thereof 湖北理工学院 2022-12-02 CN claimed
CN-115010661-A Preparation method of 7-chloroquinaldine 江西省化学工业研究所 2022-09-06 CN claimed
CN-110627737-A Water-soluble benzoxazole fluorescent probe for detecting zinc ions as well as preparation method and application thereof 湖北理工学院 2019-12-31 CN claimed
CN-110627737-B Water-soluble benzoxazole fluorescent probe for detecting zinc ions as well as preparation method and application thereof 湖北理工学院 2022-12-02 CN disclosed
CN-110627737-B Water-soluble benzoxazole fluorescent probe for detecting zinc ions as well as preparation method and application thereof 湖北理工学院 2022-12-02 CN disclosed
CN-113200890-B Water-soluble fluorescent probe ZY16 for detecting hypochlorite ions based on diaminomaleonitrile, and preparation method and application thereof 湖北理工学院 2022-06-28 CN disclosed
CN-110627737-A Water-soluble benzoxazole fluorescent probe for detecting zinc ions as well as preparation method and application thereof 湖北理工学院 2019-12-31 CN disclosed
CN-110627737-A Water-soluble benzoxazole fluorescent probe for detecting zinc ions as well as preparation method and application thereof 湖北理工学院 2019-12-31 CN disclosed