SCHEMBL8896070

SCHEMBL8896070

Nc1nc2c(c(=O)[nH]1)NCN2COC(CO)OCP(=O)(O)O

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 16/20 0.74
FGFR1 P11362 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
CYP3A4 P08684 1/20 0.34
NFKB1 P19838 1/20 0.34
BLM P54132 1/20 0.34
VCP P55072 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HIF1A Q16665 1/20 0.34
SLC22A6 Q4U2R8 1/20 0.33

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
SCHEMBL8896319 0.87 HPRT1 (0.68) HPRT1
SCHEMBL84258 0.85 HPRT1 (1.00) HPRT1FGFR1MEN1ALDH1A1LMNA
SCHEMBL9055682 0.83 HPRT1 (0.81) HPRT1FGFR1MEN1ALDH1A1LMNA
SCHEMBL147641 0.83 HPRT1 (0.67) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL7132437 0.82 HPRT1 (0.60) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL6270124 0.82 HPRT1 (0.60) HPRT1
SCHEMBL4713155 0.82 HPRT1 (0.76) HPRT1CYP3A4
SCHEMBL8899140 0.81 HPRT1 (0.74) HPRT1
Phosphoric Acid SCHEMBL15054256 0.81 HPRT1 (0.74) HPRT1CYP3A4
Phosphoric Acid SCHEMBL9471917 0.81 HPRT1 (0.59) HPRT1MEN1ALDH1A1LMNACYP3A4

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-0398231-B1 Nucleoside analogs ACAD OF SCIENCE CZECH REPUBLIC (CZ) 1997-07-16 EP claimed