SCHEMBL2580677

SCHEMBL2580677

CC(=O)OC[C@@H]1C[C@@H](OC(C)=O)[C@H](n2cc(I)c(=O)[nH]c2=O)O1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PYGM P11217 1/20 0.44
TK1 P04183 5/20 0.43
P2RY6 Q15077 5/20 0.42
P2RY14 Q15391 3/20 0.42
BCHE P06276 3/20 0.39
LMNA P02545 2/20 0.38
THRB P10828 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HIF1A Q16665 1/20 0.38
RNASE1 P07998 1/20 0.36
ALDH1A1 P00352 1/20 0.34
ALB P02768 1/20 0.34
POLB P06746 1/20 0.34
ADRA1A P35348 1/20 0.34
BLM P54132 1/20 0.34

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
SCHEMBL2580676 1.00 PYGM (0.44) PYGMTK1P2RY6P2RY14BCHE
SCHEMBL2583581 0.92 PYGM (0.41) PYGMTK1P2RY6P2RY14BCHE
SCHEMBL7212090 0.90 PYGM (0.50) PYGMTK1P2RY6P2RY14BCHE
SCHEMBL2581474 0.90 RNASE1 (0.45) TK1LMNARNASE1ALDH1A1ALB
SCHEMBL7212087 0.90 PYGM (0.50) PYGMTK1P2RY6P2RY14BCHE
SCHEMBL2581471 0.90 RNASE1 (0.45) TK1LMNARNASE1ALDH1A1ALB
SCHEMBL2585686 0.88 PYGM (0.43) PYGMTK1P2RY6P2RY14LMNA
SCHEMBL2588114 0.88 KMT2A (0.39) TK1LMNATHRBSMN1; SMN2HIF1A
SCHEMBL2585372 0.88 LMNA (0.46) P2RY6P2RY14LMNATHRBSMN1; SMN2
SCHEMBL2575179 0.88 PYGM (0.43) PYGMTK1P2RY6LMNATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10100076-B2 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation GILEAD PHARMASSET LLC (US) 2018-10-16 US disclosed
US-20140057863-A1 MODIFIED NUCLEOSIDES FOR THE TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION GILEAD SCIENCES, INC. (US) 2014-02-27 US disclosed
US-20110269707-A1 Modified nucleosides for the treatment of viral infections and abnormal cellullar proliferation PHARMASSET, INC. 2011-11-03 US disclosed
EP-1411954-B1 MODIFIED NUCLEOSIDES FOR TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION PHARMASSET INC (US) 2010-12-15 EP disclosed
EP-2251015-A1 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation Pharmasset, Inc. (US) 2010-11-17 EP disclosed
US-20090004137-A1 Uridine Derivatives as Antiviral Drugs Against a Flaviviridae, Especially Hcv INSTITUTE NATIONAL DE LA SAINTE ET DE LA RECHDERCHE MEDICALE (FR) 2009-01-01 US disclosed
EP-1827457-A1 URIDINE DERIVATIVES AS ANTIVIRAL DRUGS AGAINST A FLAVIVIRIDAE, ESPECIALLY HCV INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2007-09-05 EP disclosed
WO-2006067606-A1 URIDINE DERIVATIVES AS ANTIVIRAL DRUGS AGAINST A FLAVIVIRIDAE, ESPECIALLY HCV INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2006-06-29 WO disclosed
EP-1674104-A1 Uridine derivatives as antiviral drugs against a flaviviridae, especially HCV INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2006-06-28 EP disclosed
US-20030087873-A1 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation PHARMASSET, INC. 2003-05-08 US 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 (5 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-20140057863-A1 MODIFIED NUCLEOSIDES FOR THE TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION SLC29A1, PNP, SLC29A2 PYGM 89/4885TK1 12/4885P2RY6 221/4885
US-20110269707-A1 Modified nucleosides for the treatment of viral infections and abnormal cellullar proliferation PNP, ALPP, XDH PYGM 4/4885TK1 35/4885P2RY6 377/4885
US-10100076-B2 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation SLC29A1, SLC29A2, PNP PYGM 99/4885TK1 5/4885P2RY6 318/4885
US-20090004137-A1 Uridine Derivatives as Antiviral Drugs Against a Flaviviridae, Especially Hcv NUDT1, UMPS, UPP1 PYGM 1203/4885TK1 206/4885P2RY6 95/4885
US-20030087873-A1 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation SLC29A1, PNP, SLC29A2 PYGM 72/4885TK1 12/4885P2RY6 269/4885

“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.