SCHEMBL496845

SCHEMBL496845

CCCCCCCCCCCCOCC(COP(=O)(O)O)OCCCCCCCCCC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 14/20 1.00
LPAR1 Q92633 13/20 1.00
LPAR2 Q9HBW0 8/20 0.72
LPAR5 Q9H1C0 6/20 0.69
LPAR6 P43657 5/20 0.56
LPAR4 Q99677 5/20 0.56
ENPP2 Q13822 5/20 0.51
PLA2G2C Q5R387 1/20 0.50

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
SCHEMBL29458233 1.00 LPAR3 (1.00) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL29353224 1.00 LPAR3 (1.00) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL31439420 1.00 LPAR3 (1.00) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL30443866 1.00 LPAR3 (1.00) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL31198159 1.00 LPAR3 (1.00) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL10896195 1.00 LPAR3 (1.00) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL2813163 1.00 LPAR3 (1.00) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL2814732 1.00 LPAR3 (1.00) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL5055004 1.00 LPAR3 (1.00) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL27734843 1.00 LPAR3 (1.00) LPAR3LPAR1LPAR2LPAR5LPAR6

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160016986-A1 STABILIZED NUCLEOTIDES FOR MEDICAL TREATMENT ACHILLION PHARMACEUTICALS, INC. 2016-01-21 US disclosed
US-8106032-B2 Lipid analogs for combating tumors WAKE FOREST UNIVERSITY (US) 2012-01-31 US disclosed
US-20100249055-A1 CLOFARABINE PHOSPHOLIPID DERIVATIVES HEIDELBERG PHARMA AG (DE) 2010-09-30 US disclosed
US-20080293667-A1 Lipid analogs for combating tumors WAKE FOREST UNIVERSITY (US) 2008-11-27 US disclosed
EP-0781138-B1 LIPID ANALOGS FOR TREATING VIRAL INFECTIONS UNIV WAKE FOREST (US) 2008-05-21 EP disclosed
US-7294621-B2 Lipid analogs for combating tumors WAKE FOREST UNIVERSITY (US) 2007-11-13 US disclosed
US-7294620-B2 Lipid analogs for inhibiting HIV-1 activity WAKE FOREST UNIVERSITY (US) 2007-11-13 US disclosed
US-7294619-B2 Lipid analogs for inhibiting the activity of hepatitis B antigen WAKE FOREST UNIVERSITY (US) 2007-11-13 US disclosed
EP-1852121-A2 Lipid analogs for treating viral infections WAKE FOREST UNIVERSITY (US) 2007-11-07 EP disclosed
US-20070105812-A1 Lipid analogs for inhibiting HIV-1 activity WAKE FOREST UNIVERSITY 2007-05-10 US disclosed
US-20050080050-A1 Lipid analogs for treating viral infections WAKE FOREST UNIVERSITY (US) 2005-04-14 US disclosed
US-20040259845-A1 Lipid analogs for treating viral infections WAKE FOREST UNIVERSITY 2004-12-23 US disclosed
EP-0702556-B1 (PHOSPHO)LIPIDS FOR COMBATTING HEPATITIS B VIRUS INFECTION UNIV WAKE FOREST (US) 2002-10-23 EP disclosed
US-6030960-A INHIBITING THE PRODUCTION OF HEPATITIS VIRUS-INDUCED ANTIGENS IN A HUMAN SUBJECT BY ADMINISTERING A COMPOUND WAKE FOREST UNIVERSITY (US) 2000-02-29 US disclosed
US-5962437-A HEPATITIS, HERPES AND AIDA VIRUS WAKE FOREST UNIVERSITY (US) 1999-10-05 US disclosed
US-5770584-A ADMINISTERING AN ALKYL LIPID OR ALKYL LIPID DERIVATIVE VIRICIDES WAKE FOREST UNIVERSITY (US) 1998-06-23 US disclosed
EP-0781138-A2 LIPID ANALOGS FOR TREATING VIRAL INFECTIONS WAKE FOREST UNIVERSITY (US) 1997-07-02 EP disclosed
EP-0702556-A1 (PHOSPHO)LIPIDS FOR COMBATTING HEPATITIS B VIRUS INFECTION WAKE FOREST UNIVERSITY (US) 1996-03-27 EP disclosed
WO-1996006620-A2 LIPID ANALOGS FOR TREATING VIRAL INFECTIONS WAKE FOREST UNIVERSITY (US) 1996-03-07 WO disclosed
WO-1994028908-A2 (PHOSPHO)LIPIDS FOR COMBATTING HEPATITIS B VIRUS INFECTION WAKE FOREST UNIVERSITY (US) 1994-12-22 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 (6 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-20160016986-A1 STABILIZED NUCLEOTIDES FOR MEDICAL TREATMENT NUDT1, DUT, ADAR LPAR3 2508/4885LPAR1 2561/4885LPAR2 3158/4885
US-20070105812-A1 Lipid analogs for inhibiting HIV-1 activity SGMS1, HDLBP, LIPC LPAR3 142/4885LPAR1 64/4885LPAR2 125/4885
US-20040259845-A1 Lipid analogs for treating viral infections SGMS1, PHOSPHO1, SGMS2 LPAR3 146/4885LPAR1 83/4885LPAR2 149/4885
US-20050080050-A1 Lipid analogs for treating viral infections SGMS1, PHOSPHO1, SGMS2 LPAR3 146/4885LPAR1 83/4885LPAR2 149/4885
US-20080293667-A1 Lipid analogs for combating tumors SGMS1, PNLIP, SGMS2 LPAR3 48/4885LPAR1 32/4885LPAR2 34/4885
US-20100249055-A1 CLOFARABINE PHOSPHOLIPID DERIVATIVES PHOSPHO1, ABHD16A, SGMS2 LPAR3 307/4885LPAR1 315/4885LPAR2 229/4885

“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.