SCHEMBL4067738

SCHEMBL4067738

CCCCCCCCC(=O)N[C@@H](CN1CCCC1)[C@@H](O)c1ccc2c(c1)OCCO2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UGCG Q16739 14/20 1.00
HTR1A P08908 1/20 1.00
PTGS1 P23219 1/20 1.00
OPRM1 P35372 1/20 1.00
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
TP53 P04637 2/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2D6 P10635 1/20 0.62
CYP2C9 P11712 1/20 0.62
NFKB1 P19838 1/20 0.62
MAPK1 P28482 1/20 0.62
CYP2C19 P33261 1/20 0.62
HIF1A Q16665 1/20 0.62
MAPT P10636 1/20 0.62
MTOR P42345 1/20 0.62
GMNN O75496 1/20 0.61
LMNA P02545 1/20 0.61
BLM P54132 1/20 0.61
PMP22 Q01453 1/20 0.61

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
SCHEMBL2169484 1.00 UGCG (1.00) UGCGHTR1APTGS1OPRM1MEN1
Eliglustat SCHEMBL4057024 1.00 UGCG (1.00) UGCGHTR1APTGS1OPRM1MEN1
SCHEMBL419334 1.00 UGCG (1.00) UGCGHTR1APTGS1OPRM1MEN1
Eliglustat SCHEMBL21648647 1.00 UGCG (1.00) UGCGHTR1APTGS1OPRM1MEN1
Eliglustat SCHEMBL21252721 1.00 UGCG (1.00) UGCGHTR1APTGS1OPRM1MEN1
SCHEMBL1085008 1.00 UGCG (1.00) UGCGHTR1APTGS1OPRM1MEN1
SCHEMBL12091633 1.00 UGCG (1.00) UGCGHTR1APTGS1OPRM1MEN1
Eliglustat SCHEMBL4058275 1.00 UGCG (1.00) UGCGHTR1APTGS1OPRM1MEN1
SCHEMBL761669 1.00 UGCG (1.00) UGCGHTR1APTGS1OPRM1MEN1
Eliglustat SCHEMBL17636050 1.00 UGCG (1.00) UGCGHTR1APTGS1OPRM1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2923699-B1 METHODS OF TREATING FATTY LIVER DISEASE COMPRISING INHIBITING GLUCOSPHINGOLIPID SYNTHESIS GENZYME CORP (US) 2018-06-20 EP disclosed
US-20170281593-A1 Methods of Treating Fatty Liver Disease GENZYME CORPORATION 2017-10-05 US disclosed
US-9556155-B2 Methods of treating fatty liver disease GENZYME CORPORATION (US) 2017-01-31 US disclosed
EP-2923699-A1 METHODS OF TREATING FATTY LIVER DISEASE Genzyme Corporation (US) 2015-09-30 EP disclosed
EP-2032134-B1 METHODS OF TREATING FATTY LIVER DISEASE COMPRISING INHIBITING GLUCOSPHINGOLIPID SYNTHESIS GENZYME CORP (US) 2015-06-24 EP disclosed
US-20150051261-A1 Methods of Treating Fatty Liver Disease GENZYME CORPORATION (US) 2015-02-19 US disclosed
US-8716327-B2 Methods of treating fatty liver disease GENZYME CORPORATION (US) 2014-05-06 US disclosed
US-20100093793-A1 METHODS FOR TREATING COGNITIVE DISORDERS USING 3-ARYL-3-HYDROXY-2-AMINO-PROPIONIC ACID AMIDES, 3-HETEROARYL-3-HYDROXY-2-AMINO-PROPIONIC ACID AMIDES AND RELATED COMPOUNDS ALLERGAN, INC. (US) 2010-04-15 US disclosed
US-20100093793-A1 METHODS FOR TREATING COGNITIVE DISORDERS USING 3-ARYL-3-HYDROXY-2-AMINO-PROPIONIC ACID AMIDES, 3-HETEROARYL-3-HYDROXY-2-AMINO-PROPIONIC ACID AMIDES AND RELATED COMPOUNDS ALLERGAN, INC. (US) 2010-04-15 US disclosed
US-20090105125-A1 Methods of Treating Fatty Liver Disease GENZYME CORPORATION 2009-04-23 US disclosed
EP-2032134-A2 METHODS OF TREATING FATTY LIVER DISEASE COMPRISING INHIBITING GLUCOSPHINGOLIPID SYNTHESIS Genzyme Corporation (US) 2009-03-11 EP disclosed
WO-2007134086-A2 METHODS OF TREATING FATTY LIVER DISEASE COMPRISING INHIBITING GLUCOSPHINGOLIPID SYNTHESIS GENZYME CORPORATION (US) 2007-11-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150051261-A1 Methods of Treating Fatty Liver Disease LIPC, GYS2, PNLIP UGCG 7/4885HTR1A 3913/4885PTGS1 1157/4885
US-20170281593-A1 Methods of Treating Fatty Liver Disease LIPC, GYS2, PNLIP UGCG 7/4885HTR1A 3913/4885PTGS1 1157/4885
US-20090105125-A1 Methods of Treating Fatty Liver Disease LIPC, GYS2, PNLIP UGCG 7/4885HTR1A 3913/4885PTGS1 1157/4885
US-20100093793-A1 METHODS FOR TREATING COGNITIVE DISORDERS USING 3-ARYL-3-HYDROXY-2-AMINO-PROPIONIC ACID AMIDES, 3-HETEROARYL-3-HYDROXY-2-AMINO-PROPIONIC ACID AMIDES AND RELATED COMPOUNDS SLC1A2, AADAT, AANAT UGCG 2208/4885HTR1A 105/4885PTGS1 2245/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.