SCHEMBL5529306

SCHEMBL5529306

CCN(CCCS(=O)(=O)O)c1cc(OC)cc(OC)c1.[NaH]

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 1/20 0.36
CNR2 P34972 1/20 0.36
ALDH1A1 P00352 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ESR1 P03372 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
GAA P10253 1/20 0.35
MAPK1 P28482 1/20 0.35
GFER P55789 1/20 0.35
MTNR1A P48039 2/20 0.34
MTNR1B P49286 2/20 0.34
POLB P06746 3/20 0.34
TP53 P04637 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
PLA2G2A P14555 1/20 0.33
BLM P54132 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33

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
Water SCHEMBL20853627 0.99 MAPT (0.36) MAPTLMNAHTTCNR2ALDH1A1
SCHEMBL244699 0.99 MAPT (0.37) MAPTLMNAHTTCNR2ALDH1A1
SCHEMBL5526466 0.97 MAPT (0.36) MAPTLMNAHTTCNR2ALDH1A1
SCHEMBL5529309 0.96 MAPT (0.36) MAPTLMNAHTTCNR2ALDH1A1
SCHEMBL241158 0.91 MTNR1A (0.40) ALDH1A1ESR1MTNR1AMTNR1BPOLB
SCHEMBL20853803 0.91 MAPT (0.43) MAPTLMNACNR2ALDH1A1ESR1
SCHEMBL4143235 0.88 MTNR1A (0.39) MAPTLMNAHTTALDH1A1L3MBTL1
SCHEMBL4339833 0.87 MTNR1A (0.42) CNR2ALDH1A1ESR1MTNR1AMTNR1B
SCHEMBL309045 0.87 MTNR1A (0.50) MAPTLMNAHTTESR1SMN1; SMN2
Water SCHEMBL20853630 0.85 MTNR1A (0.49) MAPTLMNAHTTALDH1A1ESR1

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-101948906-B Reagent with protease reaction promoter and/or pigment stabilizing agent ASAHI KASEI PHARMA CORP 2013-02-27 CN disclosed
CN-101948906-A The reagent that contains protease reaction promoter and/or colorant stabilizer ASAHI KASEI PHARMA CORP 2011-01-19 CN disclosed
CN-101023168-B Reagent containing protease reaction promoter and/or pigment stabilizer ASAHI KASEI PHARMA CORP 2010-10-13 CN disclosed
US-20070224685-A1 Reagent Containing Protease Reaction Promoter and/or Colorant Stabilizer ASAHI KASEI PHARMA CORPORATION (JP) 2007-09-27 US disclosed
CN-101023168-A Reagent containing protease reaction promoter and/or pigment stabilizer ASAHI KASEI PHARMA CORP (JP) 2007-08-22 CN disclosed
EP-0353311-B1 NUCLEOSIDE OXIDASE AND ANALYTICAL METHOD USING SAME OTSUKA FOOD CO LTD (JP) 1995-01-18 EP disclosed
US-5156955-A Used as enzyme for catalyzing oxidation reaction of nucleoside OTSUKA FOODS CO., LTD. (JP) 1992-10-20 US disclosed
EP-0353311-A1 NUCLEOSIDE OXIDASE AND ANALYTICAL METHOD USING SAME OTSUKA FOODS CO., LTD. (JP) 1990-02-07 EP disclosed