SCHEMBL24371979

SCHEMBL24371979

CC1(O)C(O)C(CO)OC1n1ccc(=S)[nH]c1=O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 4/20 0.50
P2RY4 P51582 4/20 0.50
SLC29A1 Q99808 2/20 0.43
SLC28A1 O00337 1/20 0.43
SLC28A2 O43868 1/20 0.43
SLC28A3 Q9HAS3 1/20 0.43
ADORA2A P29274 3/20 0.42
P2RY6 Q15077 4/20 0.42
P2RY14 Q15391 1/20 0.41
PDE4D Q08499 1/20 0.40
PDE3A Q14432 1/20 0.40
ADORA3 P0DMS8 3/20 0.38
ADA P00813 1/20 0.38
ADORA2B P29275 1/20 0.37
ADORA1 P30542 1/20 0.37
CDA P32320 1/20 0.36

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
SCHEMBL21418832 1.00 P2RY2 (0.50) P2RY2P2RY4SLC29A1SLC28A1SLC28A2
SCHEMBL17972163 1.00 P2RY2 (0.50) P2RY2P2RY4SLC29A1SLC28A1SLC28A2
SCHEMBL18049461 1.00 P2RY2 (0.50) P2RY2P2RY4SLC29A1SLC28A1SLC28A2
SCHEMBL16575761 1.00 P2RY2 (0.50) P2RY2P2RY4SLC29A1SLC28A1SLC28A2
SCHEMBL17972251 0.88 P2RY2 (0.42) P2RY2P2RY4SLC29A1SLC28A1SLC28A2
SCHEMBL16575613 0.88 P2RY2 (0.42) P2RY2P2RY4SLC29A1SLC28A1SLC28A2
SCHEMBL18049471 0.88 ADORA2A (0.44) P2RY2P2RY4SLC29A1SLC28A1SLC28A2
SCHEMBL16575954 0.88 ADORA2A (0.44) P2RY2P2RY4SLC29A1SLC28A1SLC28A2
SCHEMBL17972178 0.88 ADORA2A (0.44) P2RY2P2RY4SLC29A1SLC28A1SLC28A2
SCHEMBL12658368 0.88 P2RY2 (0.62) P2RY2P2RY4SLC29A1SLC28A1SLC28A2

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