SCHEMBL7304459

SCHEMBL7304459

CO[PH](CC(=O)O)(OC)OC

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.35
TSHR P16473 2/20 0.33
EGLN1 Q9GZT9 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HCAR2 Q8TDS4 2/20 0.31
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
LDHA P00338 1/20 0.30
SRR Q9GZT4 1/20 0.30
LMNA P02545 1/20 0.30
ALKBH5 Q6P6C2 1/20 0.30
SUCNR1 Q9BXA5 1/20 0.30

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
SCHEMBL8530828 0.74 FFAR3 (0.40) FFAR3EGLN1ALDH1A1HCAR2HDAC3
SCHEMBL1640177 0.65
SCHEMBL1181781 0.61 FFAR3 (0.44) FFAR3TSHREGLN1ALDH1A1HDAC3
Glycolic Acid SCHEMBL3826792 0.60
Succinic Acid SCHEMBL2804358 0.60 EGLN1 (0.69) FFAR3TSHREGLN1ALDH1A1HDAC3
Propionic Acid SCHEMBL36645 0.60
Malonic Acid SCHEMBL2412964 0.60 LDHA (0.69) FFAR3TSHREGLN1ALDH1A1HCAR2
Malonic Acid SCHEMBL2509322 0.60 LDHA (0.69) FFAR3TSHREGLN1ALDH1A1HCAR2
SCHEMBL25218427 0.59 FFAR3 (0.42) FFAR3TSHREGLN1ALDH1A1HDAC3
Chloroacetic Acid SCHEMBL9267847 0.58

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1050534-B1 2,3-methano-amino acid derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2001-12-05 EP disclosed
EP-1050534-A1 2,3-methano-amino acid derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-11-08 EP disclosed