SCHEMBL20857032

SCHEMBL20857032

O=CCC(O)C(O)COP(=O)(O)O

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MPI P34949 1/20 0.62
PGD P52209 3/20 0.52
PGK1 P00558 1/20 0.45
PGK2 P07205 1/20 0.45
LPAR5 Q9H1C0 1/20 0.35
SGPL1 O95470 4/20 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
SCHEMBL4594608 1.00 MPI (0.62) MPIPGDPGK1PGK2LPAR5
SCHEMBL139868 1.00 MPI (0.62) MPIPGDPGK1PGK2LPAR5
SCHEMBL2234036 0.98 MPI (0.60) MPIPGDPGK1PGK2LPAR5
Acetaldehyde SCHEMBL22264056 0.94 MPI (0.56) MPIPGDPGK1PGK2LPAR5
SCHEMBL22227536 0.91 MPI (0.58) MPIPGDPGK1PGK2LPAR5
SCHEMBL9755644 0.91 MPI (0.58) MPIPGDPGK1PGK2LPAR5
SCHEMBL20553435 0.88 MPI (0.58) MPIPGDPGK1PGK2LPAR5
SCHEMBL213770 0.88 MPI (0.58) MPIPGDPGK1PGK2LPAR5
SCHEMBL1353551 0.88 MPI (0.58) MPIPGDPGK1PGK2LPAR5
SCHEMBL3507132 0.88 MPI (0.58) MPIPGDPGK1PGK2LPAR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020212453-A1 NEW PROCESS FOR MULTIPLE ALDOL REACTIONS UNIVERSITE CLERMONT AUVERGNE (FR) 2020-10-22 WO disclosed
EP-3688169-A2 GENETIC KNOCKOUTS IN WOOD-LJUNGDAHL MICROORGANISMS Lanzatech, Inc. (US) 2020-08-05 EP disclosed
US-20200239896-A1 GENETIC KNOCKOUTS IN WOOD-LJUNGDAHL MICROORGANISMS LANZATECH, INC. 2020-07-30 US disclosed
WO-2019068011-A2 GENETIC KNOCKOUTS IN WOOD-LJUNGDAHL MICROORGANISMS LANZATECH, INC. (US) 2019-04-04 WO disclosed
CN-1965084-A Improved 2-deoxy-D-ribose 5-phosphate aldolases and their use for producing 2,4, 6-trideoxyhexoses or 6-halo-or 6-cyano-substituted derivatives thereof DSM IP ASSETS BV (NL) 2007-05-16 CN disclosed