SCHEMBL8440926

SCHEMBL8440926

CC(C)[C@@]1(n2ccc(=O)[nH]c2=O)O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 12/20 0.56
P2RY4 P51582 8/20 0.56
P2RY6 Q15077 12/20 0.54
POLA1 P09884 1/20 0.53

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
SCHEMBL2011098 0.87 P2RY2 (0.62) P2RY2P2RY4P2RY6POLA1
SCHEMBL30423444 0.87 P2RY2 (0.60) P2RY2P2RY4P2RY6POLA1
SCHEMBL18486642 0.84 P2RY6 (0.59) P2RY2P2RY4P2RY6POLA1
SCHEMBL30697340 0.84 P2RY2 (0.58) P2RY2P2RY4P2RY6POLA1
SCHEMBL8437841 0.84 P2RY2 (0.59) P2RY2P2RY4P2RY6POLA1
SCHEMBL30367562 0.84 P2RY2 (0.57) P2RY2P2RY4P2RY6POLA1
SCHEMBL607049 0.84 POLA1 (0.60) P2RY2P2RY4P2RY6POLA1
SCHEMBL31398378 0.83 POLA1 (0.57) P2RY2P2RY4P2RY6POLA1
SCHEMBL31381447 0.83 P2RY14 (0.56) P2RY2P2RY4P2RY6POLA1
SCHEMBL8439076 0.83 P2RY2 (0.55) P2RY2P2RY4P2RY6POLA1

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