SCHEMBL18614734

SCHEMBL18614734

O=CC(O)COP(=O)(O)OC(=O)CCO

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MPI P34949 1/20 0.36
AKR1B1 P15121 1/20 0.33
PGK1 P00558 1/20 0.31
PGK2 P07205 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
SCHEMBL18614733 0.76 AKR1B1 (0.50) MPIAKR1B1
SCHEMBL14829936 0.75 MPI (0.49) MPIAKR1B1PGK1PGK2
SCHEMBL29977872 0.73 MPI (0.46) MPI
SCHEMBL9545231 0.73 MPI (0.46) MPI
SCHEMBL12323037 0.73 MPI (0.41) MPIAKR1B1PGK1PGK2
SCHEMBL34088 0.72 MPI (0.63) MPIAKR1B1PGK1PGK2
SCHEMBL328992 0.72 MPI (0.63) MPIAKR1B1PGK1PGK2
SCHEMBL10709491 0.72 MPI (0.63) MPIAKR1B1PGK1PGK2
SCHEMBL1395698 0.72 MPI (0.63) MPIAKR1B1PGK1PGK2
SCHEMBL28125367 0.72 MPI (0.63) MPIAKR1B1PGK1PGK2

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-3347479-A1 ENZYMATIC PRODUCTION OF AN ACYL PHOSPHATE FROM A 2-HYDROXYALDEHYDE Scientist of Fortune S.A. (LU) 2018-07-18 EP disclosed
WO-2017042254-A1 ENZYMATIC PRODUCTION OF AN ACYL PHOSPHATE FROM A 2-HYDROXYALDEHYDE SCIENTIST OF FORTUNE S.A. (LU) 2017-03-16 WO disclosed