SCHEMBL4952193

SCHEMBL4952193

O=c1[nH]c(=O)n([C@@H]2O[C@H](CO)[C@@H](CO)[C@@H]2O)cc1C=CBr

nearest known ligand 0.85

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TK2 O00142 9/20 0.85
TK1 P04183 2/20 0.64
CYP1A2 P05177 1/20 0.64
CYP3A4 P08684 1/20 0.64
TSHR P16473 1/20 0.64
BLM P54132 1/20 0.64
PMP22 Q01453 1/20 0.64
NPSR1 Q6W5P4 1/20 0.64
PYGM P11217 3/20 0.56

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
Sorivudine SCHEMBL4658822 0.92 TK2 (1.00) TK2TK1CYP1A2CYP3A4TSHR
Sorivudine SCHEMBL16555084 0.92 TK2 (1.00) TK2TK1CYP1A2CYP3A4TSHR
Sorivudine SCHEMBL16555082 0.92 TK2 (1.00) TK2TK1CYP1A2CYP3A4TSHR
Sorivudine SCHEMBL82640 0.92 TK2 (1.00) TK2TK1CYP1A2CYP3A4TSHR
Sorivudine SCHEMBL3503360 0.92 TK2 (1.00) TK2TK1CYP1A2CYP3A4TSHR
Sorivudine SCHEMBL13447883 0.92 TK2 (1.00) TK2TK1CYP1A2CYP3A4TSHR
Sorivudine SCHEMBL4292930 0.92 TK2 (1.00) TK2TK1CYP1A2CYP3A4TSHR
Sorivudine SCHEMBL13413053 0.92 TK2 (1.00) TK2TK1CYP1A2CYP3A4TSHR
Sorivudine SCHEMBL1981707 0.92 TK2 (1.00) TK2TK1CYP1A2CYP3A4TSHR
Sorivudine SCHEMBL5511785 0.92 TK2 (1.00) TK2TK1CYP1A2CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1284741-B1 3'-OR 2'-HYDROXYMETHYL SUBSTITUTED NUCLEOSIDE DERIVATIVES FOR TREATMENT OF VIRAL INFECTIONS PHARMASSET INC (US) 2008-11-19 EP disclosed
EP-1964569-A2 3'-or 2'-hydroxymethyl substituted nucleoside derivatives for treatment of viral infections Pharmasset, Inc. (US) 2008-09-03 EP disclosed
US-7094770-B2 3′-or 2′-hydroxymethyl substituted nucleoside derivatives for treatment of hepatitis virus infections PHARMASSET, LTD. (BB) 2006-08-22 US disclosed
US-20020055483-A1 3'-or 2'-hydroxymethyl substituted nucleoside derivatives for treatment of hepatites virus infections PHARMASSET, INC. 2002-05-09 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 (1 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-20020055483-A1 3'-or 2'-hydroxymethyl substituted nucleoside derivatives for treatment of hepatites virus infections HCCS, HDGF, HMBS TK2 54/4885TK1 65/4885CYP1A2 305/4885

“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.