SCHEMBL27705697

SCHEMBL27705697

O=C(O)CC(=O)OC(=O)CC(=O)O.[CaH2]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.50
SRR Q9GZT4 1/20 0.50
FFAR3 O14843 1/20 0.39
ALDH1A1 P00352 1/20 0.36
TSHR P16473 8/20 0.36
LMNA P02545 1/20 0.33
ALKBH5 Q6P6C2 1/20 0.33
SUCNR1 Q9BXA5 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
KDM4E B2RXH2 1/20 0.32
CTH P32929 1/20 0.32
CBS P35520 1/20 0.32
THPO P40225 1/20 0.32
GLRA1 P23415 1/20 0.32
SLC6A9 P48067 1/20 0.32
OR51E2 Q9H255 1/20 0.32
LGALS8 O00214 1/20 0.32
PRSS1 P07477 1/20 0.31
CTSG P08311 1/20 0.31
CTRB1 P17538 1/20 0.31

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
SCHEMBL27987704 1.00 LDHA (0.50) LDHASRRFFAR3ALDH1A1TSHR
SCHEMBL28003714 0.97 LDHA (0.47) LDHASRRFFAR3ALDH1A1TSHR
SCHEMBL819956 0.97 LDHA (0.53) LDHASRRFFAR3ALDH1A1TSHR
SCHEMBL10391174 0.93 LDHA (0.50) LDHASRRFFAR3ALDH1A1TSHR
SCHEMBL28109626 0.90 LDHA (0.47) LDHASRRFFAR3ALDH1A1TSHR
SCHEMBL812816 0.88 ALDH1A1 (0.46) LDHASRRFFAR3ALDH1A1TSHR
SCHEMBL7349937 0.85 FFAR3 (0.47) LDHASRRFFAR3ALDH1A1TSHR
SCHEMBL6550853 0.84 LDHA (0.47) LDHASRRFFAR3TSHRLMNA
SCHEMBL17046704 0.83 TSHR (0.52) LDHASRRFFAR3ALDH1A1TSHR
SCHEMBL10761861 0.83 TSHR (0.46) LDHASRRALDH1A1TSHRLMNA

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-101200755-A Bacterium identification reagent kit as well as preparation method and uses thereof UNIV SOUTH CHINA AGRICULT (CN) 2008-06-18 CN disclosed