SCHEMBL30385294

SCHEMBL30385294

Nc1c(S(=O)(=O)O)ccc2c(S(=O)(=O)O)cc(S(=O)(=O)O)cc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
CASP6 P55212 3/20 0.49
HSD17B10 Q99714 3/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
NT5E P21589 3/20 0.42
NSD2 O96028 2/20 0.42
DUSP3 P51452 1/20 0.42
PTPN5 P54829 1/20 0.42
PTPN11 Q06124 1/20 0.42
SENP2 Q9HC62 5/20 0.41
SENP1 Q9P0U3 4/20 0.41
SUMO2 P61956 3/20 0.41
SUMO1 P63165 3/20 0.41
SENP7 Q9BQF6 3/20 0.41
TTR P02766 1/20 0.41
TSHR P16473 2/20 0.39
SENP3 Q9H4L4 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
MEN1 O00255 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
SCHEMBL1755146 1.00 ALDH1A1 (0.49) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL30331075 0.88 ALDH1A1 (0.51) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL30331110 0.88 ALDH1A1 (0.51) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL3238294 0.88 ALDH1A1 (0.51) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL28975739 0.86 ALDH1A1 (0.50) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL27418691 0.86 ALDH1A1 (0.50) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL6205724 0.86 CASP6 (0.55) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL1755145 0.86 ALDH1A1 (0.53) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL28328009 0.82 ALDH1A1 (0.43) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL30052645 0.79 ALDH1A1 (0.50) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118222116-A Preparation method of modified grafted carbon black 上海色如丹数码科技股份有限公司 2024-06-21 CN claimed
CN-115703724-B Sulfonic acid compound, instant type heat-resistant salt-resistant polyacrylamide for oil displacement, and preparation method and application thereof 中国石油化工股份有限公司 2024-02-13 CN claimed
CN-115703724-A Sulfonic acid compound, instant temperature-resistant salt-resistant polyacrylamide for oil displacement, and preparation method and application thereof 中国石油化工股份有限公司 2023-02-17 CN claimed
CN-118222116-A Preparation method of modified grafted carbon black 上海色如丹数码科技股份有限公司 2024-06-21 CN disclosed
CN-115703724-B Sulfonic acid compound, instant type heat-resistant salt-resistant polyacrylamide for oil displacement, and preparation method and application thereof 中国石油化工股份有限公司 2024-02-13 CN disclosed
CN-115703724-A Sulfonic acid compound, instant temperature-resistant salt-resistant polyacrylamide for oil displacement, and preparation method and application thereof 中国石油化工股份有限公司 2023-02-17 CN disclosed