SCHEMBL5443285

SCHEMBL5443285

[CH2]COCn1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNP P00491 8/20 0.74
BLM P54132 2/20 0.74
HBB P68871 2/20 0.74
USP2 O75604 1/20 0.74
TSHR P16473 1/20 0.74
EDNRA P25101 1/20 0.74
HTR2A P28223 1/20 0.74
RECQL P46063 1/20 0.74
HSD17B10 Q99714 1/20 0.74
HPRT1 P00492 6/20 0.67
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
ALDH1A1 P00352 1/20 0.64
LMNA P02545 1/20 0.64
CYP3A4 P08684 1/20 0.64
NFKB1 P19838 1/20 0.64
VCP P55072 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
HIF1A Q16665 1/20 0.64
POLG P54098 1/20 0.60

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
SCHEMBL29370760 0.89 PNP (0.87) PNPBLMHBBUSP2TSHR
SCHEMBL1767748 0.86 PNP (0.74) PNPBLMHBBUSP2TSHR
Acyclovir SCHEMBL3664893 0.85 PNP (1.00) PNPBLMHBBUSP2TSHR
Acyclovir SCHEMBL2269160 0.85 PNP (1.00) PNPBLMHBBUSP2TSHR
Acyclovir SCHEMBL3175 0.85 PNP (1.00) PNPBLMHBBUSP2TSHR
SCHEMBL572050 0.85 PNP (0.81) PNPBLMHBBUSP2TSHR
Acyclovir SCHEMBL19031784 0.84 PNP (0.97) PNPBLMHBBUSP2TSHR
Acyclovir SCHEMBL16060281 0.84 PNP (0.97) PNPBLMHBBUSP2TSHR
Acyclovir SCHEMBL16061083 0.84 PNP (0.97) PNPBLMHBBUSP2TSHR
SCHEMBL10421280 0.84 PNP (0.79) PNPBLMHBBUSP2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2851368-B1 COMPLEX COMPOUNDS OF GERMANIUM, METHODS FOR PRODUCING SAME, AND DRUGS OBSCHESTVO S OGRANICHENNOI OTVETSTVENNOSTYU WDS FARMA (RU) 2019-01-02 EP claimed
EP-2852592-A1 A PROCESS FOR THE PREPARATION OF VALACYCLOVIR HYDROCHLORIDE Piramal Enterprises Limited (IN) 2015-04-01 EP claimed
WO-2013076688-A1 A PROCESS FOR THE PREPARATION OF VALACYCLOVIR HYDROCHLORIDE Piramal Enterprises Limited (IN) 2013-05-30 WO claimed
EP-0596542-B1 Therapeutic nucleosides WELLCOME FOUND (GB) 1996-05-29 EP claimed
EP-0596542-A1 Therapeutic nucleosides THE WELLCOME FOUNDATION LIMITED (GB) 1994-05-11 EP claimed
US-5061708-A TREATMENT OF INFECTION BY HERPES OR CYTOMEGALO VIRUS BURROUGHS WELLCOME CO. (US) 1991-10-29 US claimed
JP-3115284-A None JP disclosed
EP-2852592-A1 A PROCESS FOR THE PREPARATION OF VALACYCLOVIR HYDROCHLORIDE Piramal Enterprises Limited (IN) 2015-04-01 EP disclosed
CN-101708338-B Prodrug containing sterides structures and high dispersion preparation thereof INST OF RADIATION & RADICALIZATION MEDICINE THE ACADEMY OF MILITARY MEDICAL SCIENCES 2014-06-04 CN disclosed
WO-2013076688-A1 A PROCESS FOR THE PREPARATION OF VALACYCLOVIR HYDROCHLORIDE Piramal Enterprises Limited (IN) 2013-05-30 WO disclosed
CN-101708338-A Prodrug containing sterides structures and high dispersion preparation thereof INST OF RADIATION & RADICALIZA 2010-05-19 CN disclosed
US-20070112193-A1 VALACYCLOVIR PROCESS DR. REDDY'S LABORATORIES, INC. 2007-05-17 US disclosed
WO-2006035452-A1 NOVEL PSEUDOMORPH OF VALACICLOVIR HYDROCHLORIDE MATRIX LABORATORIES LTD (IN) 2006-04-06 WO disclosed
EP-0596542-B1 Therapeutic nucleosides WELLCOME FOUND (GB) 1996-05-29 EP disclosed
EP-0308065-B1 Therapeutic nucleosides WELLCOME FOUND (GB) 1995-01-04 EP disclosed
EP-0596542-A1 Therapeutic nucleosides THE WELLCOME FOUNDATION LIMITED (GB) 1994-05-11 EP disclosed
US-5061708-A TREATMENT OF INFECTION BY HERPES OR CYTOMEGALO VIRUS BURROUGHS WELLCOME CO. (US) 1991-10-29 US disclosed
JP-H03115284-A NUCLEOTIDE FOR MEDICAL TREATMENT WELLCOME FOUND LTD:THE 1991-05-16 JP disclosed
EP-0308065-A2 Therapeutic nucleosides THE WELLCOME FOUNDATION LIMITED (GB) 1989-03-22 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 (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-20070112193-A1 VALACYCLOVIR PROCESS TYMP, UMPS, PNP PNP 3/4885BLM 1781/4885HBB 2522/4885

“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.