SCHEMBL5496836

SCHEMBL5496836

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nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.45
CA1 P00915 3/20 0.45
CD274 Q9NZQ7 4/20 0.42
PDCD1LG2 Q9BQ51 2/20 0.42
TP53 P04637 1/20 0.39
MME P08473 2/20 0.39
VSIR Q9H7M9 3/20 0.38
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PRSS1 P07477 1/20 0.34
TMPRSS15 P98073 1/20 0.34
NPC1 O15118 1/20 0.34
PDCD1 Q15116 1/20 0.34

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
SCHEMBL5496832 1.00 CA2 (0.45) CA2CA1CD274PDCD1LG2TP53
SCHEMBL6664400 1.00 CA2 (0.45) CA2CA1CD274PDCD1LG2TP53
SCHEMBL28394852 1.00 CA2 (0.45) CA2CA1CD274PDCD1LG2TP53
SCHEMBL5496834 1.00 CA2 (0.45) CA2CA1CD274PDCD1LG2TP53
SCHEMBL6333157 0.83 SMN1; SMN2 (0.46) CA2CA1ALDH1A1SMN1; SMN2
SCHEMBL3286142 0.83 SMN1; SMN2 (0.46) CA2CA1ALDH1A1SMN1; SMN2
SCHEMBL4318209 0.83 SMN1; SMN2 (0.46) CA2CA1ALDH1A1SMN1; SMN2
SCHEMBL13754314 0.80 CA2 (0.43) CA2CA1CD274PDCD1LG2TP53
SCHEMBL27791579 0.80 CA2 (0.43) CA2CA1CD274PDCD1LG2TP53
SCHEMBL28865437 0.79 ACE (0.35) TP53MMEALDH1A1SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1376202-A Stereostructure of decarbamylase and use thereof KANEGAFUCHI CHEMICAL IND (JP) 2002-10-23 CN claimed
EP-1209234-A1 STEREOSTRUCTURE OF DECARBAMYLASE AND METHOD OF USING THE SAME Kaneka Corporation (JP) 2002-05-29 EP claimed
EP-1616945-B1 Process for producing D-N-carbamoyl-alpha-amino acids KANEGAFUCHI CHEMICAL IND (JP) 2007-11-21 EP disclosed
EP-0801131-B1 PROCESS FOR PRODUCING D-N-CARBAMOYL-ALPHA-AMINO ACID KANEGAFUCHI CHEMICAL IND (JP) 2007-02-21 EP disclosed
EP-1616945-A1 Process for producing D-N-carbamoyl-alpha-amino acids KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2006-01-18 EP disclosed
EP-1616946-A1 Process for producing D-N-carbamoyl-alpha-amino acids KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2006-01-18 EP disclosed
CN-1376202-A Stereostructure of decarbamylase and use thereof KANEGAFUCHI CHEMICAL IND (JP) 2002-10-23 CN disclosed
EP-1209234-A1 STEREOSTRUCTURE OF DECARBAMYLASE AND METHOD OF USING THE SAME Kaneka Corporation (JP) 2002-05-29 EP disclosed
EP-0801131-A1 PROCESS FOR PRODUCING D-N-CARBAMOYL-$g(a)-AMINO ACID Kanegafuchi Chemical Industry Co., Ltd. (JP) 1997-10-15 EP disclosed