SCHEMBL21133247

SCHEMBL21133247

CC(C)(C)C(=O)OCn1cnc2c(ncn2C2CC(F)C(COP(=O)(O)O[C@H]3CC(n4cnc5c(=O)n(COC(=O)C(C)(C)C)cnc54)OC3COP(=O)(O)O)O2)c1=O

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RY1 P47900 1/20 0.48

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
SCHEMBL21133325 0.96 P2RY1 (0.44) P2RY1
SCHEMBL21132775 0.94 P2RY1 (0.43) P2RY1
SCHEMBL21132763 0.90 P2RY1 (0.43) P2RY1
SCHEMBL21132782 0.86 P2RY1 (0.40) P2RY1
SCHEMBL21133237 0.85 RNASEL (0.39)
SCHEMBL21133198 0.83 STING1 (0.39)
SCHEMBL21133137 0.83 RNASEL (0.43)
SCHEMBL21132979 0.79 ALDH1A1 (0.39) P2RY1
SCHEMBL21133241 0.79 ALDH1A1 (0.39) P2RY1
SCHEMBL21133333 0.78 RNASEL (0.58) P2RY1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3505527-A1 CYCLIC DINUCLEOTIDES FOR CYTOKINE INDUCTION Invivogen (FR) 2019-07-03 EP disclosed