SCHEMBL5501207

SCHEMBL5501207

CN(C)OCC[C@@]1(n2cnc3c(=O)[nH]c(N)nc32)O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNP P00491 3/20 0.42
BLM P54132 2/20 0.42
USP2 O75604 1/20 0.42
TSHR P16473 1/20 0.42
EDNRA P25101 1/20 0.42
HTR2A P28223 1/20 0.42
RECQL P46063 1/20 0.42
HBB P68871 1/20 0.42
HSD17B10 Q99714 1/20 0.42
HINT1 P49773 5/20 0.42
ADORA3 P0DMS8 1/20 0.41
HPGD P15428 1/20 0.41
CYP3A4 P08684 2/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
NFKB1 P19838 1/20 0.39
VCP P55072 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL27177316 0.91 PNP (0.44) PNPBLMUSP2TSHREDNRA
SCHEMBL7098416 0.90 PNP (0.44) PNPBLMUSP2TSHREDNRA
SCHEMBL28319357 0.88 ADORA3 (0.44) PNPBLMUSP2TSHREDNRA
SCHEMBL6826568 0.87 ADORA3 (0.45) PNPBLMUSP2TSHREDNRA
SCHEMBL6889007 0.86 TK1 (0.43) PNPBLMUSP2TSHREDNRA
SCHEMBL5611914 0.86 ADORA3 (0.46) PNPBLMUSP2TSHREDNRA
SCHEMBL28286364 0.86 ADORA3 (0.49) PNPBLMUSP2TSHREDNRA
SCHEMBL28167650 0.85 ADORA3 (0.42) PNPBLMUSP2TSHREDNRA
SCHEMBL7196156 0.85 ADORA3 (0.43) PNPBLMUSP2TSHREDNRA
SCHEMBL9232430 0.85 ADORA3 (0.46) 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-0977767-B1 AMINOOXY-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS INC (US) 2007-09-19 EP disclosed