SCHEMBL8437313

SCHEMBL8437313

CCCC=C(C)CC(OP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 1/20 0.46
P2RX2 Q9UBL9 1/20 0.46
P2RY2 P41231 1/20 0.44
RNASEL Q05823 1/20 0.42
P2RY1 P47900 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
SCHEMBL8441129 0.92 P2RY2 (0.55) P2RX3P2RX2P2RY2RNASELP2RY1
SCHEMBL8440902 0.90 P2RY1 (0.42) P2RX3P2RX2P2RY2RNASELP2RY1
SCHEMBL8438431 0.88 P2RY2 (0.46) P2RX3P2RX2P2RY2P2RY1
SCHEMBL8436302 0.87 P2RX3 (0.51) P2RX3P2RX2P2RY2P2RY1
SCHEMBL8440635 0.87 P2RY2 (0.51) P2RX3P2RX2P2RY2RNASELP2RY1
SCHEMBL8441096 0.87 P2RY2 (0.43) P2RX3P2RX2P2RY2RNASELP2RY1
SCHEMBL8436367 0.87 P2RY2 (0.43) P2RX3P2RX2P2RY2RNASELP2RY1
SCHEMBL8441734 0.86 P2RX3 (0.53) P2RX3P2RX2P2RY2
SCHEMBL8435672 0.86 P2RY2 (0.44) P2RX3P2RX2P2RY2RNASELP2RY1
SCHEMBL8441079 0.83 P2RY2 (0.47) P2RX3P2RX2P2RY2P2RY1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5902793-A ADMINISTERING TO MAMMAL GAMMA-MONOALKYL- OR GAMMA-ALKENYL-NUCLEOSIDE OR DEOXYNUCLEOSIDE TRIPHOSPHATE ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 1999-05-11 US claimed
US-5902793-A ADMINISTERING TO MAMMAL GAMMA-MONOALKYL- OR GAMMA-ALKENYL-NUCLEOSIDE OR DEOXYNUCLEOSIDE TRIPHOSPHATE ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 1999-05-11 US disclosed
US-5639653-A ADMINISTERING MONOALKYL- OR ALKENYL-PYROPHOSPHATE TO MAMMAL TO STIMULATE LYMPHOCYTE CELL GROWTH AND ENHANCE IMMUNE RESPONSE ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY, A DIVISION OF YESHIVA UNIVERSTIY (US) 1997-06-17 US disclosed