SCHEMBL28263244

SCHEMBL28263244

C=C(Cl)OS(=O)(=O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.44
ALDH1A1 P00352 7/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
HSD17B10 Q99714 1/20 0.43
TSHR P16473 1/20 0.43
DUSP3 P51452 1/20 0.41
PTPN5 P54829 1/20 0.41
PTPN11 Q06124 1/20 0.41
MAPT P10636 5/20 0.41
LMNA P02545 1/20 0.41
HTR6 P50406 1/20 0.41
PARL Q9H300 1/20 0.40
KDM4E B2RXH2 3/20 0.39
KMT2A Q03164 2/20 0.39
HPGD P15428 1/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39

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
SCHEMBL4126515 0.83 SMN1; SMN2 (0.43) TDP1ALDH1A1SMN1; SMN2HSD17B10TSHR
SCHEMBL15352489 0.83 TDP1 (0.47) TDP1ALDH1A1SMN1; SMN2HSD17B10TSHR
SCHEMBL31469869 0.82 KDM4E (0.42) TDP1ALDH1A1SMN1; SMN2TSHRMAPT
SCHEMBL28867389 0.80 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2LMNAKMT2ACA1
SCHEMBL9388412 0.79 TSHR (0.43) TDP1ALDH1A1SMN1; SMN2HSD17B10TSHR
SCHEMBL18139101 0.78 TSHR (0.41) TDP1ALDH1A1SMN1; SMN2TSHRMAPT
SCHEMBL18140394 0.78 TSHR (0.41) TDP1ALDH1A1SMN1; SMN2TSHRMAPT
SCHEMBL18141216 0.78 TSHR (0.41) TDP1ALDH1A1SMN1; SMN2TSHRMAPT
Ammonia Solution, Strong SCHEMBL18140062 0.78 TSHR (0.41) TDP1ALDH1A1SMN1; SMN2TSHRMAPT
SCHEMBL18140630 0.78 TSHR (0.41) TDP1ALDH1A1SMN1; SMN2TSHRMAPT

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-109232394-A A kind of fluorescent molecule, preparation method and application identifying copper ion 四川中科微纳科技有限公司 2019-01-18 CN disclosed