SCHEMBL9910548

SCHEMBL9910548

O=CC(O)CC(O)C(O)CC(O)C=O

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.53
MPI P34949 1/20 0.31
GAPDH P04406 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
SCHEMBL447075 0.89 AKR1B1 (0.57) AKR1B1
SCHEMBL1747065 0.89 AKR1B1 (0.57) AKR1B1
SCHEMBL16600332 0.89 AKR1B1 (0.57) AKR1B1
SCHEMBL1658629 0.89 AKR1B1 (0.57) AKR1B1
SCHEMBL5319919 0.89 AKR1B1 (0.57) AKR1B1
SCHEMBL319227 0.89 AKR1B1 (0.57) AKR1B1
SCHEMBL16600465 0.87 AKR1B1 (0.42) AKR1B1GAPDH
SCHEMBL17105637 0.84 AKR1B1 (0.46) AKR1B1
SCHEMBL16600128 0.84 AKR1B1 (0.46) AKR1B1
SCHEMBL3425314 0.83 AKR1B1 (0.43) AKR1B1GAPDH

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
US-8197640-B2 For paper or paperboard; mixture of polyacrylamide and aldehyde generating compound; high strength BERCEN, INC. (US) 2012-06-12 US disclosed
US-20080216979-A1 Paper making process using cationic polyacrylamides and crosslinking compositions for use in same BERCEN INCORPORATED 2008-09-11 US disclosed