SCHEMBL24371577

SCHEMBL24371577

COC(CO)[C@H](O)C(C)(O)n1ccc(=O)[nH]c1=S

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 2/20 0.32
P2RY6 Q15077 1/20 0.32
DUT P33316 1/20 0.30

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
SCHEMBL12031271 0.88 DUT (0.36) P2RY14P2RY6DUT
SCHEMBL19881999 0.88 DUT (0.36) P2RY14P2RY6DUT
SCHEMBL24371356 0.83
SCHEMBL24371615 0.79 P2RY2 (0.44) P2RY14P2RY6
SCHEMBL24372004 0.77 DUT (0.35) P2RY14P2RY6DUT
SCHEMBL22086850 0.77 DUT (0.35) P2RY6DUT
SCHEMBL18661677 0.77 DUT (0.35) P2RY14P2RY6DUT
SCHEMBL24371371 0.77 P2RY14 (0.34) P2RY14P2RY6
SCHEMBL24371799 0.77 P2RY14 (0.34) P2RY14P2RY6
SCHEMBL24371667 0.76

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-3043803-B1 NUCLEOTIDE AND NUCLEOSIDE COMPOSITIONS AND THEIR USES UNIV EMORY (US) 2022-04-27 EP disclosed