SCHEMBL18059144

SCHEMBL18059144

Nc1nc2c(ncn2COC2CCCC(c3ccccc3)OC2)c(=O)[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 11/20 0.50
▸ BLM P54132 2/20 0.47
▸ USP2 O75604 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ EDNRA P25101 1/20 0.47
▸ HTR2A P28223 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ HBB P68871 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ VCP P55072 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ HPRT1 P00492 4/20 0.44
▸ XDH P47989 1/20 0.43

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
SCHEMBL14121679 0.86 PNP (0.54) PNPBLMUSP2TSHREDNRA
SCHEMBL18059141 0.81 PNP (0.54) PNPBLMUSP2TSHREDNRA
SCHEMBL97280 0.74 PNP (0.53) PNPBLMUSP2TSHREDNRA
SCHEMBL10402774 0.74 PNP (0.57) PNPBLMUSP2TSHREDNRA
SCHEMBL13528364 0.73 PNP (0.52) PNPBLMUSP2TSHREDNRA
SCHEMBL18744083 0.73 PNP (0.54) PNPBLMUSP2TSHREDNRA
SCHEMBL29503314 0.73 PNP (0.56) PNPBLMUSP2TSHREDNRA
SCHEMBL14137223 0.73 PNP (0.51) PNPBLMUSP2TSHREDNRA
SCHEMBL7614528 0.73 PNP (0.58) PNPBLMUSP2TSHREDNRA
SCHEMBL14125281 0.70 PNP (0.50) PNPBLMUSP2TSHREDNRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2714691-B1 PROCESS FOR THE PREPARATION OF 2-AMINO-9-((2-PHENYL-1,3-DIOXAN-5-YLOXY)METHYL)-1H-PURIN-6(9H)-ONE COMPOUND USEFUL IN THE PREPARATION OF VALGANCICLOVIR PHARMATHEN SA (GR) 2016-09-07 — — EP disclosed
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