SCHEMBL1739832

SCHEMBL1739832

CCCCCCCCCCCCSCC(COP(=O)(O)O)OCCCCCCCCCC

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 12/20 0.68
LPAR1 Q92633 10/20 0.68
LPAR2 Q9HBW0 5/20 0.50
LPAR5 Q9H1C0 3/20 0.50
ENPP2 Q13822 5/20 0.46
LPAR6 P43657 2/20 0.46
LPAR4 Q99677 2/20 0.46
TLR2 O60603 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL5081834 1.00 LPAR3 (0.68) LPAR3LPAR1LPAR2LPAR5ENPP2
SCHEMBL14032166 1.00 LPAR3 (0.68) LPAR3LPAR1LPAR2LPAR5ENPP2
SCHEMBL11082621 0.92 LPAR3 (0.57) LPAR3LPAR1LPAR2LPAR5ENPP2
SCHEMBL11079228 0.92 LPAR3 (0.57) LPAR3LPAR1LPAR2LPAR5ENPP2
SCHEMBL11083607 0.91 LPAR3 (0.56) LPAR3LPAR1LPAR2LPAR5ENPP2
SCHEMBL11091806 0.91 LPAR3 (0.56) LPAR3LPAR1LPAR2LPAR5ENPP2
SCHEMBL11081544 0.90 LPAR3 (0.54) LPAR3LPAR1LPAR2LPAR5ENPP2
SCHEMBL4747959 0.90 LPAR3 (0.54) LPAR3LPAR1LPAR2LPAR5ENPP2
SCHEMBL11088254 0.90 LPAR3 (0.54) LPAR3LPAR1LPAR2LPAR5ENPP2
SCHEMBL11079136 0.90 LPAR3 (0.54) LPAR3LPAR1LPAR2LPAR5ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021198725-A1 FOSALVUDINE AND FOZIVUDINE TIDOXIL FOR USE IN THE TREATMENT OF COVID-19, AND USE OF THE STRUCTURALLY SIMPLIFIED DERIVATIVES THEREOF CHIRACON GMBH (DE) 2021-10-07 WO disclosed
US-20170183373-A1 NUCLEOSIDE DERIVATIVES AS INHIBITORS OF RNA-DEPENDENT RNA VIRAL POLYERMASE MERCK SHARP & DOHME CORP. (US) 2017-06-29 US disclosed
US-20140309412-A1 NUCLEOSIDE DERIVATIVES AS INHIBITORS OF RNA-DEPENDENT RNA VIRAL POLYMERASE IONIS PHARMACEUTICALS, INC. 2014-10-16 US disclosed
US-8481712-B2 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase MERCK SHARP & DOHME CORP. (US) 2013-07-09 US disclosed
US-20120165515-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase MERCK SHARP & DOHME LLC 2012-06-28 US disclosed
EP-2399588-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase Merck Sharp & Dohme Corp. (US) 2011-12-28 EP disclosed
EP-2360166-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase Merck Sharp & Dohme Corp. (US) 2011-08-24 EP disclosed
US-20080249066-A1 ANTIVIRAL COMPOUNDS AND COMPOSITIONS ARDEA BIOSCIENCES, INC. (US) 2008-10-09 US disclosed
US-20080249066-A1 ANTIVIRAL COMPOUNDS AND COMPOSITIONS ARDEA BIOSCIENCES, INC. (US) 2008-10-09 US disclosed
US-7419965-B2 Nucleotide lipid ester derivatives HEIDELBERG PHARMA AG (DE) 2008-09-02 US disclosed
US-20040110717-A1 Nucleoside derivatives as inhibitors of rna-dependent rna viral polymerase MERCK SHARP & DOHME LLC 2004-06-10 US disclosed
US-20040072788-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase BHAT BALKRISHEN (US) 2004-04-15 US disclosed
US-20040067901-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase MERCK SHARP & DOHME LLC 2004-04-08 US disclosed
US-20020147160-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase MERCK SHARP & DOHME LLC 2002-10-10 US disclosed
WO-2002057425-A2 NUCLEOSIDE DERIVATIVES AS INHIBITORS OF RNA-DEPENDENT RNA VIRAL POLYMERASE MERCK & CO., INC. (US) 2002-07-25 WO disclosed
EP-0741740-B1 METHOD OF PREPARING UNSYMMETRICAL PHOSPHORIC ACID DIESTERS AND SALTS ROCHE DIAGNOSTICS GMBH (DE) 1999-04-07 EP disclosed
US-5734042-A Process for the production of asymmetrical phosphoric acid diesters BOEHRINGER MANNHEIM GMBH (DE) 1998-03-31 US disclosed
EP-0741740-A1 METHOD OF PREPARING UNSYMMETRICAL PHOSPHORIC ACID DIESTERS AND SALTS Roche Diagnostics GmbH (DE) 1996-11-13 EP disclosed
WO-1995020596-A1 METHOD OF PREPARING UNSYMMETRICAL PHOSPHORIC ACID DIESTERS BOEHRINGER MANNHEIM GMBH (DE) 1995-08-03 WO disclosed
EP-0545966-A1 NEW PHOSPHOLIPID DERIVATIVES OF NUCLEOSIDES, THEIR PREPARATION AND THEIR USE AS ANTIVIRAL DRUGS. BOEHRINGER MANNHEIM GMBH (DE) 1993-06-16 EP 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 (8 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-20040067901-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase NSUN2, NSUN3, POLRMT LPAR3 1491/4885LPAR1 1790/4885LPAR2 2624/4885
US-20080249066-A1 ANTIVIRAL COMPOUNDS AND COMPOSITIONS PNP, TYMP, MTAP LPAR3 1438/4885LPAR1 1211/4885LPAR2 2035/4885
US-20040110717-A1 Nucleoside derivatives as inhibitors of rna-dependent rna viral polymerase NSUN2, NSUN3, POLRMT LPAR3 1766/4885LPAR1 2125/4885LPAR2 2978/4885
US-20170183373-A1 NUCLEOSIDE DERIVATIVES AS INHIBITORS OF RNA-DEPENDENT RNA VIRAL POLYERMASE POLRMT, DUT, RNASE1 LPAR3 2811/4885LPAR1 3256/4885LPAR2 3932/4885
US-20040072788-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase NSUN2, NSUN3, POLRMT LPAR3 1491/4885LPAR1 1790/4885LPAR2 2624/4885
US-20140309412-A1 NUCLEOSIDE DERIVATIVES AS INHIBITORS OF RNA-DEPENDENT RNA VIRAL POLYMERASE NSUN2, NSUN3, POLRMT LPAR3 1491/4885LPAR1 1790/4885LPAR2 2624/4885
US-20020147160-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase NSUN2, NSUN3, POLRMT LPAR3 1491/4885LPAR1 1790/4885LPAR2 2624/4885
US-20120165515-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase NSUN2, NSUN3, POLRMT LPAR3 1491/4885LPAR1 1790/4885LPAR2 2624/4885

“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.