SCHEMBL18486642

SCHEMBL18486642

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

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 12/20 0.59
P2RY2 P41231 10/20 0.59
P2RY4 P51582 6/20 0.59
POLA1 P09884 1/20 0.53
P2RY14 Q15391 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 0.98 P2RY2 (0.62) P2RY6P2RY2P2RY4POLA1
SCHEMBL18486630 0.91 P2RY2 (0.48) P2RY6P2RY2P2RY4P2RY14
SCHEMBL30874770 0.91 P2RY6 (0.53) P2RY6P2RY2P2RY4P2RY14
SCHEMBL38662148 0.89 P2RY6 (0.56) P2RY6P2RY2P2RY4P2RY14
SCHEMBL30697340 0.87 P2RY2 (0.58) P2RY6P2RY2P2RY4POLA1P2RY14
SCHEMBL30893603 0.87 P2RY6 (0.56) P2RY6P2RY2P2RY4POLA1P2RY14
SCHEMBL2800175 0.87 P2RY6 (0.58) P2RY6P2RY2P2RY4POLA1P2RY14
SCHEMBL30821917 0.87 P2RY6 (0.58) P2RY6P2RY2P2RY4POLA1P2RY14
Pyrophosphoric Acid SCHEMBL18486638 0.86 P2RY6 (0.47) P2RY6P2RY2P2RY4P2RY14
SCHEMBL31301048 0.86 P2RY2 (0.45) P2RY6P2RY2P2RY4P2RY14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10103401-B2 Polymer electrolyte composition and polymer electrolyte membrane, polymer electrolyte membrane with catalyst layer, membrane electrode assembly, and polymer electrolyte fuel cell each using the same TORAY INDUSTRIES, INC. (JP) 2018-10-16 US disclosed
EP-3131145-B1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE-ELECTROLYTE ASSEMBLY, AND SOLID POLYMER FUEL CELL USING SAME TORAY INDUSTRIES (JP) 2018-09-05 EP disclosed
US-20170125832-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE WITH CATALYST LAYER, MEMBRANE ELECTRODE ASSEMBLY, AND POLYMER ELECTROLYTE FUEL CELL EACH USING THE SAME TORAY INDUSTRIES, INC. (JP) 2017-05-04 US disclosed
EP-3131145-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE-ELECTROLYTE ASSEMBLY, AND SOLID POLYMER FUEL CELL USING SAME Toray Industries, Inc. (JP) 2017-02-15 EP disclosed