Glycerin

Glycerin

SCHEMBL3433694

CCC(C)OC(C)CC.OCC(O)CO

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.47
ALDH1A1 P00352 1/20 0.47
TSHR P16473 4/20 0.39
TDP1 Q9NUW8 1/20 0.38
USP2 O75604 1/20 0.34
THRB P10828 1/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 1/20 0.31
DUSP3 P51452 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
Propylene Glycol SCHEMBL4899757 0.86 TDP1 (0.56) LMNAALDH1A1TSHRTDP1MAPK1
Propylene Glycol SCHEMBL27888673 0.84 TDP1 (0.53) LMNAALDH1A1TSHRTDP1MAPK1
SCHEMBL224938 0.83
SCHEMBL13254103 0.83
Glycerin SCHEMBL28830316 0.83 LMNA (0.53) LMNAALDH1A1TSHRTDP1USP2
Alcohol SCHEMBL10454582 0.83 TSHR (0.40) ALDH1A1TSHRTDP1MAPK1
Ethylene Glycol SCHEMBL4899588 0.80 TSHR (0.38) ALDH1A1TSHRTDP1MAPK1
SCHEMBL5791362 0.80
SCHEMBL147241 0.80
SCHEMBL14000783 0.80

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-2262753-A1 NEW OXYGENATED COMPONENTS FOR FUELS AND PREPARATION THEREOF ENI S.p.A. (IT) 2010-12-22 EP disclosed
WO-2009115273-A1 NEW OXYGENATED COMPONENTS FOR FUELS AND PREPARATION THEREOF ENI S.P.A. (IT) 2009-09-24 WO disclosed