SCHEMBL6700217

SCHEMBL6700217

O=P(O)(O)CP(=O)(O)OP(=O)(O)CP(=O)(O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.56
MMP2 P08253 1/20 0.56
THRB P10828 1/20 0.56
MAPK1 P28482 1/20 0.56
HSD17B10 Q99714 1/20 0.56
OTC P00480 1/20 0.41
BLM P54132 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
FDPS P14324 1/20 0.39
TYMS P04818 1/20 0.35
PPARD Q03181 1/20 0.35
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
KMT2A Q03164 1/20 0.32
PGK1 P00558 1/20 0.32
PGK2 P07205 1/20 0.32

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
SCHEMBL13113828 0.83 KDM4E (0.45) KDM4EMMP2THRBMAPK1HSD17B10
SCHEMBL2324839 0.83 TYMS (0.55) KDM4EMMP2THRBMAPK1HSD17B10
SCHEMBL13113824 0.79 KDM4E (0.41) KDM4EMMP2THRBMAPK1HSD17B10
SCHEMBL2064554 0.78 KDM4E (0.53) KDM4EMMP2THRBMAPK1HSD17B10
SCHEMBL1563641 0.77 PPARD (0.56) KDM4EMMP2THRBMAPK1HSD17B10
SCHEMBL5968120 0.75 KDM4E (0.50) KDM4EMMP2THRBMAPK1HSD17B10
SCHEMBL2331836 0.75 KDM4E (0.50) KDM4EMMP2THRBMAPK1HSD17B10
SCHEMBL1562522 0.75 KDM4E (0.50) KDM4EMMP2THRBMAPK1HSD17B10
SCHEMBL7825106 0.75 KDM4E (0.50) KDM4EMMP2THRBMAPK1HSD17B10
SCHEMBL13163283 0.74 KDM4E (0.36) KDM4EMMP2THRBMAPK1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040266723-A1 Antiviral agents for treatment of Flaviviridae infections PHARMASSET, INC. 2004-12-30 US disclosed
EP-1469003-A2 Tetraphosphonate bicyclic trisanhydrides Pharmasset, Ltd. (US) 2004-10-20 EP disclosed
US-20040181078-A1 Tetraphosphonate bicyclic trisanhydrides PHARMASSET, LTD. 2004-09-16 US disclosed
US-6713623-B2 USEFUL AS INTERMEDIATES IN THE SYNTHESIS OF BIOLOGICALLY ACTIVE COMPOUNDS PHARMASSET, LTD. 2004-03-30 US disclosed
EP-1366055-A2 ANTIVIRAL AGENTS FOR TREATMENT OF FLAVIVIRIDAE INFECTIONS Pharmasset Limited (BB) 2003-12-03 EP disclosed
US-20020161220-A1 Tetraphosphonate bicyclic trisanhydrides GILEAD PHARMASSET LLC 2002-10-31 US disclosed
WO-2002048165-A2 ANTIVIRAL AGENTS FOR TREATMENT OF FLAVIVIRIDAE INFECTIONS PHARMASSET LTD. (BB) 2002-06-20 WO disclosed
US-6326490-B1 ANTIPROLIFERATION AGENTS OR ANTICARCINOGENIC AGENTS PHARMASSET, LTD. 2001-12-04 US disclosed
EP-0934325-A4 TETRAPHOSPHONATE BICYCLIC TRISANHYDRIDES PHARMASSET LTD (US) 2000-08-16 EP disclosed
EP-0934325-A1 TETRAPHOSPHONATE BICYCLIC TRISANHYDRIDES Pharmasset, Ltd. (US) 1999-08-11 EP disclosed
WO-1998015563-A1 TETRAPHOSPHONATE BICYCLIC TRISANHYDRIDES PHARMASSET, LTD. (US) 1998-04-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040181078-A1 Tetraphosphonate bicyclic trisanhydrides IDH1, PPIP5K2, DHPS KDM4E 3656/4885MMP2 1773/4885THRB 3173/4885
US-20040266723-A1 Antiviral agents for treatment of Flaviviridae infections HAVCR2, MAVS, EIF2AK2 KDM4E 1744/4885MMP2 1043/4885THRB 4722/4885
US-20020161220-A1 Tetraphosphonate bicyclic trisanhydrides IDH1, PPIP5K2, DHPS KDM4E 3656/4885MMP2 1773/4885THRB 3173/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.