SCHEMBL2811458

SCHEMBL2811458

COC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@@H](O)[C@@H]1O

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.73
THRB P10828 1/20 0.73
MTOR P42345 1/20 0.73
MDM2 Q00987 1/20 0.73
NCOA1 Q15788 1/20 0.73
NCOA3 Q9Y6Q9 1/20 0.73
L3MBTL1 Q9Y468 1/20 0.63
TSHR P16473 1/20 0.62
GLA P06280 1/20 0.62
P2RY2 P41231 3/20 0.59
ST6GAL1 P15907 4/20 0.56
P2RY4 P51582 1/20 0.53
P2RY6 Q15077 1/20 0.53

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
SCHEMBL17304691 1.00 LMNA (0.73) LMNATHRBMTORMDM2NCOA1
SCHEMBL15338532 1.00 LMNA (0.73) LMNATHRBMTORMDM2NCOA1
SCHEMBL158513 1.00 LMNA (0.73) LMNATHRBMTORMDM2NCOA1
SCHEMBL18231346 1.00 LMNA (0.73) LMNATHRBMTORMDM2NCOA1
SCHEMBL13524621 1.00 LMNA (0.73) LMNATHRBMTORMDM2NCOA1
SCHEMBL383499 1.00 LMNA (0.73) LMNATHRBMTORMDM2NCOA1
SCHEMBL14178411 1.00 LMNA (0.73) LMNATHRBMTORMDM2NCOA1
Trifluoroacetic Acid SCHEMBL4666697 0.92 LMNA (0.62) LMNATHRBMTORMDM2NCOA1
SCHEMBL5964221 0.91 LMNA (0.70) LMNATHRBMTORMDM2NCOA1
SCHEMBL888543 0.90 LMNA (0.66) LMNATHRBMTORMDM2NCOA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9249173-B2 Compounds and pharmaceutical compositions for the treatment of viral infections IDENIX PHARMACEUTICALS, LLC (US) 2016-02-02 US claimed
US-9624249-B2 Nucleoside kinase bypass compositions and methods MERCK SHARP & DOHME CORP. (US) 2017-04-18 US disclosed
US-20170101431-A1 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF CANCER IDENIX PHARMACEUTICALS LLC (US) 2017-04-13 US disclosed
EP-2909223-B1 DINUCLEOTIDE COMPOUNDS FOR HCV INFECTION IDENIX PHARMACEUTICALS LLC (US) 2017-03-22 EP disclosed
US-20150315221-A1 NUCLEOSIDE KINASE BYPASS COMPOSITIONS AND METHODS MERCK SHARP & DOHME CORP. (US) 2015-11-05 US disclosed
WO-2014088923-A1 NUCLEOSIDE KINASE BYPASS COMPOSITIONS AND METHODS MERCK SHARP & DOHME CORP. (US) 2014-06-12 WO disclosed
US-20140112886-A1 DINUCLEOTIDE COMPOUNDS FOR HCV INFECTION IDENIX PHARMACEUTICALS LLC 2014-04-24 US disclosed
US-8586559-B2 Spinal muscular atrophy (SMA) treatment via targeting of SMN2 splice site inhibitory sequences UNIVERSITY OF MASSACHUSETTS (US) 2013-11-19 US disclosed
US-20130028956-A1 METHOD FOR PREVENTING OR TREATING MEMORY IMPAIRMENT AND PHARMACEUTICAL COMPOSITIONS USEFUL THEREFORE GEORG-AUGUST-UNIVERSITAET GOETTINGEN STIFTUNG OEFFENTLICHEN RECHTS UNIVERSITAETSMEDIZIN (DE) 2013-01-31 US disclosed
US-20120165394-A1 SPINAL MUSCULAR ATROPHY (SMA) TREATMENT VIA TARGETING OF SMN2 SPLICE SITE INHIBITORY SEQUENCES UNIVERSITY OF MASSACHUSETTS (US) 2012-06-28 US disclosed
US-20100240604-A1 PROTECTED NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2010-09-23 US disclosed
US-7645745-B2 Propionic Acid (2R,3R,4R,5R)-5-(4-amino-2-oxo-2H-pyrimidin-1-yl)-4-hydroxy-4-methyl-3-propionyloxy-tetrahydro-furan-2-ylmethyl ester; inhibit RNA-dependent RNA viral replication and are useful as inhibitors of HCV NS5B polymerase ROCHE PALO ALTO LLC (US) 2010-01-12 US disclosed
EP-1556398-B1 NOVEL CYTARABINE MONOPHOSPHATE PRODRUGS METABASIS THERAPEUTICS INC (US) 2009-09-09 EP disclosed
EP-2004634-A1 3',5'-DI-O-ACYLATED NUCLEOSIDES FOR HCV TREATMENT F.HOFFMANN-LA ROCHE AG (CH) 2008-12-24 EP disclosed
WO-2007113159-A1 3',5'-DI-O-ACYLATED NUCLEOSIDES FOR HCV TREATMENT F. HOFFMANN-LA ROCHE AG (CH) 2007-10-11 WO disclosed
US-20070232562-A1 Antiviral nucleosides ROCHE PALO ALTO LLC 2007-10-04 US disclosed
US-20070032448-A1 Sugar modified nucleosides as viral replication inhibitors RIBAPHARM INC. 2007-02-08 US disclosed
EP-1572705-A2 SUGAR MODIFIED NUCLEOSIDES AS VIRAL REPLICATION INHIBITORS Ribapharm, Inc. (US) 2005-09-14 EP disclosed
US-20040158054-A1 Di-ribonucleotides as specific viral RNA-polymerase inhibitors for the treatment or prevention of viral infections RIBAPHARM INC. 2004-08-12 US disclosed
WO-2003062255-A2 SUGAR MODIFIED NUCLEOSIDES AS VIRAL REPLICATION INHIBITORS RIBAPHARM INC. (US) 2003-07-31 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 (7 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-20170101431-A1 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF CANCER TYMP, NSUN2, PNP LMNA 544/4885THRB 4618/4885MTOR 2063/4885
US-20140112886-A1 DINUCLEOTIDE COMPOUNDS FOR HCV INFECTION NSUN2, NUDT1, NSUN3 LMNA 609/4885THRB 3123/4885MTOR 2642/4885
US-20070232562-A1 Antiviral nucleosides RNGTT, PNP, NSUN2 LMNA 1934/4885THRB 3711/4885MTOR 1362/4885
US-20150315221-A1 NUCLEOSIDE KINASE BYPASS COMPOSITIONS AND METHODS DCK, DTYMK, TK1 LMNA 4073/4885THRB 2923/4885MTOR 758/4885
US-20100240604-A1 PROTECTED NUCLEOTIDE ANALOGS PNP, NTPCR, TYMP LMNA 1360/4885THRB 3705/4885MTOR 2721/4885
US-20070032448-A1 Sugar modified nucleosides as viral replication inhibitors PNP, MTAP, GALE LMNA 4188/4885THRB 4389/4885MTOR 988/4885
US-20040158054-A1 Di-ribonucleotides as specific viral RNA-polymerase inhibitors for the treatment or prevention of viral infections POLRMT, ADAR, RNGTT LMNA 1985/4885THRB 4225/4885MTOR 4145/4885

“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.