SCHEMBL18409552

SCHEMBL18409552

O=CC(O)CO.O=C[C@H](O)[C@@H](OP(=O)(O)O)[C@H](O)[C@H](O)CO

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.44
MPI P34949 1/20 0.41
LMNA P02545 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL1922060 0.94 MPI (0.46) AKR1B1MPILMNAL3MBTL1
SCHEMBL177758 0.94 MPI (0.46) AKR1B1MPILMNAL3MBTL1
SCHEMBL5972505 0.94 MPI (0.46) AKR1B1MPILMNAL3MBTL1
SCHEMBL11790470 0.83 MPI (0.48) AKR1B1MPI
SCHEMBL7152900 0.83 MPI (0.48) AKR1B1MPI
SCHEMBL3235190 0.83 MPI (0.48) AKR1B1MPI
SCHEMBL7148553 0.80 MPI (0.46) AKR1B1MPILMNAL3MBTL1
SCHEMBL4601534 0.80 MPI (0.46) AKR1B1MPILMNAL3MBTL1
SCHEMBL9736910 0.79 MPI (0.37) AKR1B1MPILMNAL3MBTL1
SCHEMBL9739554 0.79 MPI (0.37) AKR1B1MPILMNAL3MBTL1

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
US-9555052-B2 Intrauterine fetal growth restriction—the biochemical rationale of treatment modalities including extraperitoneal transamniotic fetal supplements PATURU SUMATHI (US) 2017-01-31 US disclosed