SCHEMBL3707586

SCHEMBL3707586

CCCCCCCCCCCCCCCCCC(=O)OC[C@H](CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)Cn1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 14/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPK1 P28482 1/20 0.40
HBB P68871 1/20 0.40
PDE3A Q14432 1/20 0.37

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
SCHEMBL3707584 1.00 HPRT1 (0.40) HPRT1MEN1KMT2AMAPK1HBB
SCHEMBL3707587 1.00 HPRT1 (0.40) HPRT1MEN1KMT2AMAPK1HBB
SCHEMBL710555 0.95 MEN1 (0.43) HPRT1MEN1KMT2AMAPK1HBB
SCHEMBL710554 0.95 MEN1 (0.43) HPRT1MEN1KMT2AMAPK1HBB
SCHEMBL712711 0.92 HPRT1 (0.41) HPRT1MEN1KMT2AMAPK1HBB
SCHEMBL712712 0.92 HPRT1 (0.41) HPRT1MEN1KMT2AMAPK1HBB
SCHEMBL8450120 0.91 HPRT1 (0.42) HPRT1MEN1KMT2AMAPK1HBB
SCHEMBL710730 0.89 MEN1 (0.45) HPRT1MEN1KMT2AMAPK1HBB
SCHEMBL710731 0.89 MEN1 (0.45) HPRT1MEN1KMT2AMAPK1HBB
SCHEMBL710793 0.86 MEN1 (0.51) HPRT1MEN1KMT2AMAPK1HBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120123119-A1 ACYCLIC NUCLEOSIDE DERIVATIVES MEDIVIR AB (SE) 2012-05-17 US disclosed
US-20090076041-A1 ACYCLIC NUCLEOSIDE DERIVATIVES MEDIVIR AB (SE) 2009-03-19 US disclosed
US-7432274-B2 Acyclic nucleoside derivatives MEDIVIR AB (SE) 2008-10-07 US disclosed
US-7189849-B2 Synthesis of acyclic nucleoside derivatives MEDIVIR AB (SE) 2007-03-13 US disclosed
US-20050250795-A1 Synthesis of acyclic nucleoside derivatives MEDIVIR AB (SE) 2005-11-10 US disclosed
US-6878844-B2 Synthesis of acyclic nucleoside derivatives MEDIVIR AB (SE) 2005-04-12 US disclosed
US-20040248910-A1 Synthesis of acyclic nucleoside derivatives MEDIVIR AB (SE) 2004-12-09 US disclosed
US-20040132749-A1 Acyclic nucleoside derivatives MEDIVIR AB (SE) 2004-07-08 US disclosed
US-6703394-B2 VIRICIDES SUCH AS (R)-9-(2-(STEAROYLOXYMETHYL)-4-(L-VALYLOXY) BUTYL)GUANINE FOR TREATMENT OF HIV; BIOAVAILABILITY MEDIVIR AB (SE) 2004-03-09 US disclosed
US-20040024214-A1 Synthesis of acyclic nucleoside derivatives MEDIVIR AB (SE) 2004-02-05 US disclosed
EP-0880521-B1 SYNTHESIS OF ACYCLIC NUCLEOSIDES MEDIVIR AB (SE) 2003-01-22 EP disclosed
US-20020188125-A1 Acyclic nucleoside derivatives MEDIVIR AB 2002-12-12 US disclosed
US-6255312-B1 VIRICIDES MEDIVIR AB (SE) 2001-07-03 US disclosed
US-6184376-B1 POTENT ANTIVIRALS, ESPECIALLY AGAINST HERPES INFECTIONS, SUCH AS THOSE CAUSED BY VARICELLA ZOSTER VIRUS, HERPES SIMPLEX, EPSTEIN-BARR VIRUS, HERPES TYPE 6 (HHV-6) AND TYPE 8 (HHV-8). SHINGLES IN THE ELDERLY OR CHICKEN POX IN THE YOUNG MEDIVER AB (SE) 2001-02-06 US disclosed
EP-0971923-A2 SYNTHESIS OF ACYCLIC NUCLEOSIDE DERIVATIVES MEDIVIR AB (SE) 2000-01-19 EP disclosed
EP-0888348-A1 ACYCLIC NUCLEOSIDE DERIVATIVES Medivir Aktiebolag (SE) 1999-01-07 EP disclosed
EP-0880521-A1 SYNTHESIS OF ACYCLIC NUCLEOSIDES Medivir Aktiebolag (SE) 1998-12-02 EP disclosed
WO-1998034917-A2 SYNTHESIS OF ACYCLIC NUCLEOSIDE DERIVATIVES MEDIVIR AB (SE) 1998-08-13 WO disclosed
WO-1997030051-A1 ACYCLIC NUCLEOSIDE DERIVATIVES MEDIVIR AB (SE) 1997-08-21 WO disclosed
WO-1997030052-A1 SYNTHESIS OF ACYCLIC NUCLEOSIDES MEDIVIR AB (SE) 1997-08-21 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-20090076041-A1 ACYCLIC NUCLEOSIDE DERIVATIVES NUDT1, PNP, NSUN2 HPRT1 19/4885MEN1 1917/4885KMT2A 2396/4885
US-20120123119-A1 ACYCLIC NUCLEOSIDE DERIVATIVES NUDT1, PNP, NSUN2 HPRT1 16/4885MEN1 1895/4885KMT2A 2400/4885
US-20040024214-A1 Synthesis of acyclic nucleoside derivatives NSUN2, SLC28A1, NUDT1 HPRT1 33/4885MEN1 1883/4885KMT2A 2577/4885
US-20040132749-A1 Acyclic nucleoside derivatives NSUN2, NUDT1, PNP HPRT1 25/4885MEN1 2312/4885KMT2A 2483/4885
US-20040248910-A1 Synthesis of acyclic nucleoside derivatives NSUN2, SLC28A1, NUDT1 HPRT1 33/4885MEN1 1883/4885KMT2A 2577/4885
US-20050250795-A1 Synthesis of acyclic nucleoside derivatives ASNS, NUDT1, PNP HPRT1 32/4885MEN1 1376/4885KMT2A 2608/4885
US-20020188125-A1 Acyclic nucleoside derivatives NSUN2, NUDT1, PNP HPRT1 20/4885MEN1 2510/4885KMT2A 2354/4885

“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.