SCHEMBL28249275

SCHEMBL28249275

Nc1cc(S(=O)(=O)O)cc2ccc(S(=O)(=O)O)c(S(=O)(=O)O)c12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.58
▸ HSD17B10 Q99714 3/20 0.58
▸ CASP6 P55212 3/20 0.58
▸ CYP2C9 P11712 1/20 0.58
▸ CYP2C19 P33261 1/20 0.58
▸ NT5E P21589 4/20 0.56
▸ SUMO2 P61956 1/20 0.50
▸ SUMO1 P63165 1/20 0.50
▸ SENP7 Q9BQF6 1/20 0.50
▸ SENP2 Q9HC62 1/20 0.50
▸ CYP1A2 P05177 2/20 0.45
▸ MEN1 O00255 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ENPP2 Q13822 3/20 0.41
▸ PHLPP2 Q6ZVD8 1/20 0.41
▸ NSD2 O96028 3/20 0.41
▸ DUSP3 P51452 1/20 0.41
▸ PTPN5 P54829 1/20 0.41
▸ PTPN11 Q06124 1/20 0.41

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
SCHEMBL28118185 0.85 NT5E (0.63) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL6864856 0.85 NT5E (0.58) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL1755049 0.82 SUMO2 (0.59) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL11429354 0.80 NT5E (0.56) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL30867217 0.80 NT5E (0.56) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL149843 0.80 NT5E (0.56) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL29386756 0.80 NT5E (0.56) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL11426413 0.79 NT5E (0.68) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL2730688 0.79 NT5E (0.68) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL152377 0.79 NT5E (0.68) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110715997-A Polysaccharide determination and analysis method and application thereof 李绍平 2020-01-21 — — CN claimed
CN-118258782-A Method for measuring content of wolfberry polysaccharide by utilizing Fourier transform infrared spectrum 宁夏五行科技有限公司 2024-06-28 — — CN disclosed
CN-110715997-B Polysaccharide determination and analysis method and application thereof 李绍平 2022-05-31 — — CN disclosed
CN-110715997-A Polysaccharide determination and analysis method and application thereof 李绍平 2020-01-21 — — CN disclosed
CN-104238267-B Color composition for color filter and colour filter 东洋油墨SC控股株式会社 2018-11-06 — — CN disclosed
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