SCHEMBL13714879

SCHEMBL13714879

C=C(COCP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(CO)n1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.61
POLG P54098 2/20 0.61
POLA1 P09884 1/20 0.61
HPRT1 P00492 10/20 0.53
PNP P00491 4/20 0.51
BLM P54132 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
CYP3A4 P08684 1/20 0.43
NFKB1 P19838 1/20 0.43
VCP P55072 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HIF1A Q16665 1/20 0.43
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

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
SCHEMBL6004502 0.89 HPRT1 (0.67) HPRT1PNPBLMMEN1ALDH1A1
SCHEMBL3861507 0.89 HPRT1 (0.59) POLBPOLGPOLA1HPRT1PNP
SCHEMBL3861491 0.88 HPRT1 (0.53) POLBPOLGPOLA1HPRT1PNP
Phosphonic Acid SCHEMBL3861471 0.86 HPRT1 (0.62) HPRT1PNPBLMMEN1ALDH1A1
SCHEMBL13714833 0.82 ENPP1 (0.49) POLBPOLGPOLA1CYP3A4
SCHEMBL3861483 0.82 HPRT1 (0.56) HPRT1PNPBLMMEN1ALDH1A1
SCHEMBL3861499 0.81 HPRT1 (0.61) POLBPOLGPOLA1HPRT1PNP
SCHEMBL15078256 0.81 POLB (0.66) POLBPOLGPOLA1HPRT1PNP
SCHEMBL15078165 0.80 POLB (0.73) POLBPOLGPOLA1HPRT1PNP
SCHEMBL15078160 0.78 POLB (0.72) POLBPOLGPOLA1HPRT1PNP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7579332-B2 Nucleobase phosphonate analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2009-08-25 US disclosed
US-7579332-B2 Nucleobase phosphonate analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2009-08-25 US disclosed