SCHEMBL8445570

SCHEMBL8445570

CCCOCCOCn1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNP P00491 8/20 0.76
HBB P68871 2/20 0.76
BLM P54132 2/20 0.76
TSHR P16473 2/20 0.76
USP2 O75604 1/20 0.76
EDNRA P25101 1/20 0.76
HTR2A P28223 1/20 0.76
RECQL P46063 1/20 0.76
HSD17B10 Q99714 1/20 0.76
HPRT1 P00492 5/20 0.68
MEN1 O00255 3/20 0.67
KMT2A Q03164 3/20 0.67
MAPK1 P28482 1/20 0.66
POLG P54098 1/20 0.65
ALDH1A1 P00352 1/20 0.59
LMNA P02545 1/20 0.59
CYP3A4 P08684 1/20 0.59
NFKB1 P19838 1/20 0.59
VCP P55072 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59

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
SCHEMBL10421280 0.97 PNP (0.79) PNPHBBBLMTSHRUSP2
SCHEMBL29370760 0.92 PNP (0.87) PNPHBBBLMTSHRUSP2
SCHEMBL8665621 0.92 PNP (0.71) PNPHBBBLMTSHRUSP2
SCHEMBL12786355 0.90 PNP (0.76) PNPHBBBLMTSHRUSP2
SCHEMBL11730981 0.89 PNP (0.95) PNPHBBBLMTSHRUSP2
SCHEMBL13040195 0.89 PNP (0.77) PNPHBBBLMTSHRUSP2
SCHEMBL28721440 0.88 PNP (0.73) PNPHBBBLMTSHRUSP2
Acyclovir SCHEMBL9479083 0.88 PNP (0.93) PNPHBBBLMTSHRUSP2
SCHEMBL1767748 0.87 PNP (0.74) PNPHBBBLMTSHRUSP2
SCHEMBL14757459 0.86 PNP (0.80) PNPHBBBLMTSHRUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0704445-B1 Preparation of N-9 substituted guanine compounds HOFFMANN LA ROCHE (CH) 1999-04-21 EP disclosed
US-5565565-A Preparation of N-9 substituted guanine compounds SYNTEX (U.S.A.) INC. (US) 1996-10-15 US disclosed
EP-0704445-A1 Preparation of N-9 substituted guanine compounds F. Hoffmann-La Roche AG (CH) 1996-04-03 EP disclosed