SCHEMBL4969963

SCHEMBL4969963

Nc1ncnc2c1ncn2[C@H]1CC[C@@H](COP(=O)(O)OP(=O)(O)O)O1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 6/20 0.61
P2RX1 P51575 4/20 0.61
P2RX2 Q9UBL9 2/20 0.61
P2RX4 Q99571 5/20 0.59
P2RY1 P47900 4/20 0.59
P2RY2 P41231 4/20 0.59
SRC P12931 1/20 0.59
ALDH1A1 P00352 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
POLB P06746 1/20 0.58
RNASEL Q05823 1/20 0.57
MACROD2 A1Z1Q3 1/20 0.55
SIRT6 Q8N6T7 1/20 0.55
MACROD1 Q9BQ69 1/20 0.55
TRPM2 O94759 1/20 0.55
P2RX7 Q99572 1/20 0.55
P2RY12 Q9H244 1/20 0.55

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
SCHEMBL31229395 1.00 P2RX3 (0.61) P2RX3P2RX1P2RX2P2RX4P2RY1
SCHEMBL23978230 1.00 P2RX3 (0.61) P2RX3P2RX1P2RX2P2RX4P2RY1
Dda-Triphosphate SCHEMBL30586994 0.99 P2RX3 (0.63) P2RX3P2RX1P2RX2P2RX4P2RY1
Dda-Triphosphate SCHEMBL79815 0.99 P2RX3 (0.63) P2RX3P2RX1P2RX2P2RX4P2RY1
Dda-Triphosphate SCHEMBL30301198 0.99 P2RX3 (0.63) P2RX3P2RX1P2RX2P2RX4P2RY1
Dda-Triphosphate SCHEMBL24767736 0.99 P2RX3 (0.63) P2RX3P2RX1P2RX2P2RX4P2RY1
SCHEMBL8630966 0.99 P2RX3 (0.63) P2RX3P2RX1P2RX2P2RX4P2RY1
Dda-Triphosphate SCHEMBL23978346 0.99 P2RX3 (0.63) P2RX3P2RX1P2RX2P2RX4P2RY1
Dda-Triphosphate SCHEMBL12932305 0.99 P2RX3 (0.63) P2RX3P2RX1P2RX2P2RX4P2RY1
SCHEMBL12932333 0.93 POLB (0.56) P2RX3P2RX1P2RX2P2RX4P2RY1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1240355-B1 REMOVAL OF DYE-LABELED DIDEOXY TERMINATORS FROM DNA SEQUENCING REACTIONS CAMBREX BIO SCIENCE ROCKLAND I (US) 2008-08-27 EP disclosed
EP-1240355-A4 REMOVAL OF DYE-LABELED DIDEOXY TERMINATORS FROM DNA SEQUENCING REACTIONS PROLINX INC (US) 2004-12-08 EP disclosed
US-6818760-B1 COMPRISES ADSORBING UNINCORPORATED MOLECULES INTO POROUS HYDROPHOBIC PARTICLES ENCAPSULATED IN A HYDROPHILIC MATRIX; KITS PROLINX INCORPORATED 2004-11-16 US disclosed
US-6599887-B2 Aids, herpes virus CHIMERIX, INC. 2003-07-29 US disclosed
EP-1240355-A1 REMOVAL OF DYE-LABELED DIDEOXY TERMINATORS FROM DNA SEQUENCING REACTIONS PROLINX, INC. (US) 2002-09-18 EP disclosed
US-6448392-B1 LIPID, ESPECIALLY PHOSPHOLIPID, DERIVATIVES OF MODIFIED ANTIVIRAL NUCLEOSIDE ANALOGUES CAN BE INTEGRATED INTO STRUCTURE OF LIPOSOMES, FORMING STABLE LIPOSOMAL COMPLEX, DELIVER GREATER AMOUNTS OF DRUGS TO CELLS WITH LESS TOXICITY CHIMERIX, INC. 2002-09-10 US disclosed
US-6414136-B1 ADSORPTION OF FLUORESCENT DYE-LABELED MOLECULES NOT INCORPORATED IN POLYMER ONTO HYDROPHOBIC MATERIAL AFTER PASSING THROUGH HYDROPHILIC MATRIX PROLINX, INC. 2002-07-02 US disclosed
US-20010033862-A1 Methods of treating viral infections using antiviral liponucleotides HOSTETLER KARL Y (US) 2001-10-25 US disclosed
US-6252060-B1 COMPLEX CONTAINING DIDEOXYGUANOSINE NEXSTAR PHARMACEUTICALS, INC. 2001-06-26 US disclosed
WO-2001025491-A1 REMOVAL OF DYE-LABELED DIDEOXY TERMINATORS FROM DNA SEQUENCING REACTIONS PROLINX, INC. (US) 2001-04-12 WO disclosed
WO-2001025490-A1 REMOVAL OF DYE-LABELED DIDEOXY TERMINATORS FROM DNA SEQUENCING REACTIONS PROLINX, INC. (US) 2001-04-12 WO disclosed
EP-0350287-B1 Lipid derivatives of antiviral nucleosides, liposomal incorporation and method of use CHIMERIX INC (US) 2000-09-27 EP disclosed
US-5817638-A USING HYBRID NUCLEOSIDES NEXSTAR PHARMACEUTICALS, INC. (US) 1998-10-06 US disclosed
EP-0594677-A4 ANTIVIRAL LIPONUCLEOSIDES: TREATMENT OF HEPATITIS B VICAL INC (US) 1997-09-17 EP disclosed
EP-0594677-A1 ANTIVIRAL LIPONUCLEOSIDES: TREATMENT OF HEPATITIS B NeXstar Pharmaceuticals, Inc. (US) 1994-05-04 EP disclosed
US-5223263-A Viricide complex; aids therapy VICAL, INC. (US) 1993-06-29 US disclosed
WO-1993000910-A1 ANTIVIRAL LIPONUCLEOSIDES: TREATMENT OF HEPATITIS B VICAL, INC. (US) 1993-01-21 WO disclosed
WO-1990000555-A1 LIPID DERIVATIVES OF ANTIVIRAL NUCLEOSIDES, LIPOSOMAL INCORPORATION AND METHOD OF USE VICAL, INC. (US) 1990-01-25 WO disclosed
EP-0350287-A2 Lipid derivatives of antiviral nucleosides, liposomal incorporation and method of use NeXstar Pharmaceuticals, Inc. (US) 1990-01-10 EP 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-20010033862-A1 Methods of treating viral infections using antiviral liponucleotides PHOSPHO1, TK1, TYMP P2RX3 1523/4885P2RX1 1434/4885P2RX2 1568/4885

“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.