Glycerin

Glycerin

SCHEMBL3843494

CN1CC(C(=O)O)CC1=O.CN1CC(C(=O)O)CC1=O.CN1CC(C(=O)O)CC1=O.OCC(O)CO

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
BRD4 O60885 4/20 0.50
POLB P06746 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.43
KMT2A Q03164 1/20 0.42
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
RECQL P46063 1/20 0.41
GAA P10253 2/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GLA P06280 1/20 0.40
RCE1 Q9Y256 1/20 0.40
ALOX15 P16050 1/20 0.40
HTT P42858 1/20 0.38

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
SCHEMBL3821889 0.86 BRD4 (0.51) MAPTBRD4POLBSMN1; SMN2KMT2A
SCHEMBL119901 0.86 BRD4 (0.63) MAPTBRD4POLBSMN1; SMN2KMT2A
SCHEMBL2811918 0.86 BRD4 (0.63) MAPTBRD4POLBSMN1; SMN2KMT2A
SCHEMBL15684270 0.86 BRD4 (0.63) MAPTBRD4POLBSMN1; SMN2KMT2A
SCHEMBL30307671 0.86 BRD4 (0.63) MAPTBRD4POLBSMN1; SMN2KMT2A
SCHEMBL3826960 0.83 BRD4 (0.53) MAPTBRD4POLBSMN1; SMN2KMT2A
Glycerin SCHEMBL3843204 0.79 POLB (0.83) MAPTPOLBSMN1; SMN2KMT2AALDH1A1
Triethylene Glycol SCHEMBL1362131 0.78 BRD4 (0.51) MAPTBRD4POLBSMN1; SMN2KMT2A
SCHEMBL29265031 0.77 POLB (0.67) MAPTPOLBSMN1; SMN2KMT2ACASP1
Glycerin SCHEMBL3844851 0.75 POLB (0.45) POLBSMN1; SMN2KMT2AHTT

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
EP-2028247-A1 Use of 1-alkyl-5-oxo-pyrrolidine-3-carbolic acid esters as gas hydrate inhibitors with improved biological degradability CLARIANT INTERNATIONAL LTD. (CH) 2009-02-25 EP disclosed