SCHEMBL5162103

SCHEMBL5162103

CCCCCOP(=O)(O)OC(=O)[C@H](C)NOC

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 6/20 0.44
LPAR2 Q9HBW0 5/20 0.44
LPAR1 Q92633 2/20 0.44
P2RY10 O00398 5/20 0.38
GPR34 Q9UPC5 2/20 0.38
PLA2G2A P14555 4/20 0.38

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
SCHEMBL10664173 0.75 LPAR3 (0.51) LPAR3LPAR2LPAR1P2RY10GPR34
SCHEMBL9711831 0.73 LPAR3 (0.57) LPAR3LPAR2LPAR1P2RY10GPR34
SCHEMBL21764567 0.73 LPAR3 (0.57) LPAR3LPAR2LPAR1P2RY10GPR34
SCHEMBL497151 0.72 LPAR3 (0.71) LPAR3LPAR2LPAR1P2RY10
SCHEMBL15876073 0.72 LPAR3 (0.60) LPAR3LPAR2LPAR1P2RY10GPR34
Isopropyl Alcohol SCHEMBL27837425 0.71 LPAR3 (0.64) LPAR3LPAR2LPAR1P2RY10GPR34
SCHEMBL3824229 0.70 LPAR3 (0.63) LPAR3LPAR2LPAR1PLA2G2A
Phosphoric Acid SCHEMBL4949196 0.70 LPAR3 (0.68) LPAR3LPAR2LPAR1P2RY10
SCHEMBL11806157 0.70 LPAR3 (0.68) LPAR3LPAR2LPAR1P2RY10
SCHEMBL150117 0.70 LPAR3 (0.68) LPAR3LPAR2LPAR1P2RY10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1594976-A4 ARYL PHOSPHATE DERIVATIVES OF d4T HAVING ACTIVITY AGAINST RESISTANT HIV STRAINS PARKER HUGHES INST (US) 2007-11-07 EP disclosed
US-20070015733-A1 Aryl Phosphate Derivatives of d4T having Activity Against Resistant HIV Strains PARKER HUGHES INSTITUTE (US) 2007-01-18 US disclosed
US-20060293285-A1 Aryl Phosphate Derivatives of d4T PARKER HUGHES INSTITUTE (US) 2006-12-28 US disclosed
US-7144874-B2 Aryl phosphate derivatives of d4T having activity against resistant HIV strains PARKER HUGHES INSTITUTE (US) 2006-12-05 US disclosed
US-7071176-B2 Aryl phosphate derivatives of AZT having anti-HIV activity PARKER HUGHES INSTITUTE (US) 2006-07-04 US disclosed
US-20050277620-A1 Aryl phosphate derivatives of d4T PARKER HUGHES INSTITUTE (US) 2005-12-15 US disclosed
EP-1594976-A2 ARYL PHOSPHATE DERIVATIVES OF d4T HAVING ACTIVITY AGAINST RESISTANT HIV STRAINS Parker Hughes Institute (US) 2005-11-16 EP disclosed
US-20050143339-A1 Aryl phosphate derivatives of D4T with potent anti-viral activity PARKER HUGHES INSTITUTE (US) 2005-06-30 US disclosed
EP-1334108-B1 ARYL PHOSPHATE DERIVATIVES OF d4T PARKER HUGHES INST (US) 2005-06-15 EP disclosed
US-6825177-B2 2',3'-DIDEHYDRO-3'-DEOXYTHYMIDINE (D4T); EXTENDING THE ELIMINATION HALF-LIFE OF D4T METABOLITE IN A MAMMAL ADMINISTERING SAID DERIVATIVE; TREATING HUMAN IMMUNODEFICIENCY VIRUS (HIV) PARKER HUGHES INSTITUTE 2004-11-30 US disclosed
EP-1334108-A1 ARYL PHOSPHATE DERIVATIVES OF d4T Parker Hughes Institute (US) 2003-08-13 EP disclosed
US-6537975-B1 Aryl phosphate derivatives of d4T with para-bromo substitution on the aryl group show markedly increased potency as anti-HIV agents without undesirable levels of cytotoxic activity. In particular, these derivatives are potent PARKER HUGHES INSTITUTE 2003-03-25 US disclosed
US-6528495-B1 Para-bromo substitution on the aryl group shows markedly increased potency without undesirable levels of cytotoxic activity; inhibitors of HIV reverse transcriptase; phosphorus of the aryl phosphate is substituted with an amino acid PARKER HUGHES INSTITUTE 2003-03-04 US disclosed
US-6503890-B1 Reverse transcriptase inhibitors PARKER HUGHES INSTITUTE 2003-01-07 US disclosed
US-20020137726-A1 Aryl phosphate derivatives of D4T with potent anti-viral activity PARKER HUGHES INSTITUTE 2002-09-26 US disclosed
WO-2002038576-A1 ARYL PHOSPHATE DERIVATIVES OF d4T PARKER HUGHES INSTITUTE (US) 2002-05-16 WO disclosed
US-6350736-B1 phenyl methoxyalaninyl phosphate derivatives of 2',3'-didehydro-2',3'-dideoxythymidine with an electron-withdrawing moiety, such as p-bromo, for enhanced hydrolysis, have increased potency without high cytotoxic activity; inhibitors of HIV reverse transcriptase; thymidine-kinase (TK)-deficient cells PARKER HUGHES INSTITUTE 2002-02-26 US disclosed
EP-1090018-A1 ARYL PHOSPHATE DERIVATIVES OF d4T HAVING ANTI-HIV ACTIVITY Parker Hughes Institute (US) 2001-04-11 EP disclosed
US-6030957-A INHIBITING HIV(HUMAN IMMUNODEFICIENCY VIRUS) REVERSE TRANSCIPTASE IN CELLS INFECTED WITH HIV BY ADMINISTERING TO INFECTED CELLS ARYLPHOSPHATE DERIVATIVE OF 2',3'-DIDEHYDRO-2',3'-DIDEOXYTHYMIDINE WAYNE HUGHES INSTITUTE (US) 2000-02-29 US disclosed
WO-2000000501-A1 ARYL PHOSPHATE DERIVATIVES OF d4T HAVING ANTI-HIV ACTIVITY PARKER HUGHES INSTITUTE (US) 2000-01-06 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 (5 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-20070015733-A1 Aryl Phosphate Derivatives of d4T having Activity Against Resistant HIV Strains TYMP, PNP, APRT LPAR3 2905/4885LPAR2 3640/4885LPAR1 3008/4885
US-20050277620-A1 Aryl phosphate derivatives of d4T PNP, MTAP, TYMP LPAR3 2948/4885LPAR2 2565/4885LPAR1 3045/4885
US-20020137726-A1 Aryl phosphate derivatives of D4T with potent anti-viral activity TYMP, PNP, GART LPAR3 2945/4885LPAR2 2720/4885LPAR1 2724/4885
US-20060293285-A1 Aryl Phosphate Derivatives of d4T PNP, TYMP, APRT LPAR3 3161/4885LPAR2 4006/4885LPAR1 3512/4885
US-20050143339-A1 Aryl phosphate derivatives of D4T with potent anti-viral activity TYMP, PNP, APRT LPAR3 2809/4885LPAR2 2442/4885LPAR1 2507/4885

“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.