SCHEMBL3393435

SCHEMBL3393435

O=C(O)C=CCO[PH](=O)O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
GABRR1 P24046 2/20 0.41
GABRR2 P28476 2/20 0.41
BLM P54132 2/20 0.41
GABRR3 A8MPY1 1/20 0.41
LMNA P02545 1/20 0.41
APEX1 P27695 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TP53 P04637 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
EGLN3 Q9H6Z9 1/20 0.35
HCAR2 Q8TDS4 2/20 0.31

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
SCHEMBL7639922 0.80
SCHEMBL788281 0.73
Crotonic Acid SCHEMBL28625666 0.72
SCHEMBL28726001 0.72 TSHR (0.50) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL3394986 0.71
SCHEMBL11636633 0.71
SCHEMBL1533442 0.71
SCHEMBL458329 0.71
SCHEMBL3363074 0.71
SCHEMBL23829583 0.70

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1185692-B1 MONOLAYER AND ELECTRODE FOR DETECTING A LABEL-BEARING TARGET AND METHOD OF USE THEREOF UNIV NORTH CAROLINA (US) 2005-12-07 EP claimed
JP-2002542794-A 2002-12-17 JP claimed
US-6387625-B1 ELECTRODE HAVING SUBSTRATE WITH ELECTROCONDUCTIVE WORKING SURFACE; SURFACE HAS NONCONDUCTIVE SELF-ASSEMBLED MONOLAYER WITH PHOSPHONATE GROUP; A TRANSITION METAL COMPLEX IS USED TO TRANSFER ELECTRONS FROM REACTANT TO SURFACE THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2002-05-14 US claimed
EP-1185692-A1 MONOLAYER AND ELECTRODE FOR DETECTING A LABEL-BEARING TARGET AND METHOD OF USE THEREOF The University of North Carolina at Chapel Hill (US) 2002-03-13 EP claimed
WO-2000065099-A1 MONOLAYER AND ELECTRODE FOR DETECTING A LABEL-BEARING TARGET AND METHOD OF USE THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2000-11-02 WO claimed
US-6127127-A Monolayer and electrode for detecting a label-bearing target and method of use thereof THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2000-10-03 US claimed
CN-109790259-A Copolymer and the medical material for using it 东丽株式会社 2019-05-21 CN disclosed
CN-107405431-A Antithrombotic metal material 东丽株式会社 2017-11-28 CN disclosed
US-7649015-B2 Cellular accumulation of phosphonate analogs of HIV protease inhibitor compounds GILEAD SCIENCES, INC. (US) 2010-01-19 US disclosed
EP-1509537-B9 CELLULAR ACCUMULATION OF PHOSPHONATE ANALOGS OF HIV PROTEASE INHIBITOR COMPOUNDS AND THE COMPOUNDS AS SUCH GILEAD SCIENCES INC (US) 2007-11-14 EP disclosed
EP-1509537-B1 CELLULAR ACCUMULATION OF PHOSPHONATE ANALOGS OF HIV PROTEASE INHIBITOR COMPOUNDS AND THE COMPOUNDS AS SUCH GILEAD SCIENCES INC (US) 2007-07-18 EP disclosed
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds GILEAD SCIENCES, INC. 2007-01-11 US disclosed
EP-1711617-A1 METHOD AND COMPOSITIONS FOR IDENTIFYING ANTI-HIV THERAPEUTICS COMPOUNDS GILEAD SCIENCES, INC. (US) 2006-10-18 EP disclosed
US-20020037530-A1 Detection of binding reactions using labels detected by mediated catalytic electrochemistry STEWART DAVID H (US) 2002-03-28 US disclosed
EP-1185692-A1 MONOLAYER AND ELECTRODE FOR DETECTING A LABEL-BEARING TARGET AND METHOD OF USE THEREOF The University of North Carolina at Chapel Hill (US) 2002-03-13 EP disclosed
US-6346387-B1 CONTACTING IMMOBILIZED BINDER WITH TEST SAMPLE TO COMPLEX TARGET; CONTACTING WITH SECOND BINDER HAVING EXOGENOUS OR ENDOGENOUS LABEL; OXIDATION WITH TRANSITION METAL COMPOUND; DETECTING OXIDATION-REDUCTION REACTION XANTHON, INC. 2002-02-12 US disclosed
WO-2000065099-A1 MONOLAYER AND ELECTRODE FOR DETECTING A LABEL-BEARING TARGET AND METHOD OF USE THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2000-11-02 WO disclosed
US-6127127-A Monolayer and electrode for detecting a label-bearing target and method of use thereof THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2000-10-03 US disclosed
WO-1995006751-A9 METHODS FOR ISOLATION OF MOST ABUNDANT OLIGONUCLEOTIDES FROM COMPLEX MIXTURES 1995-04-20 WO disclosed
WO-1995006751-A1 METHODS FOR ISOLATION OF MOST ABUNDANT OLIGONUCLEOTIDES FROM COMPLEX MIXTURES PHARMAGENICS, INC. (US) 1995-03-09 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 (1 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-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds PPA1, PNP, PPME1 TSHR 4782/4885GABRR1 4016/4885GABRR2 4171/4885

“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.