SCHEMBL19590303

SCHEMBL19590303

CC(C)(C)[Si](OC[C@@]1(C=O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](F)[C@@H]1O)(c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DUT P33316 3/20 0.36
NT5E P21589 1/20 0.36
P2RY14 Q15391 3/20 0.35
SLC28A1 O00337 1/20 0.35
SLC28A2 O43868 1/20 0.35
SLC29A1 Q99808 1/20 0.35
SLC28A3 Q9HAS3 1/20 0.35
P2RY2 P41231 3/20 0.35
P2RY6 Q15077 2/20 0.34

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
SCHEMBL19590304 0.92 DUT (0.36) DUTNT5EP2RY14SLC28A1SLC28A2
SCHEMBL19590300 0.89 NT5E (0.34) DUTNT5EP2RY14SLC28A1SLC28A2
SCHEMBL19590312 0.88 P2RY6 (0.40) DUTNT5EP2RY14SLC28A1SLC28A2
SCHEMBL19590302 0.85 NT5E (0.39) DUTNT5EP2RY14SLC28A1SLC28A2
SCHEMBL19590311 0.84 SLC28A1 (0.37) DUTNT5EP2RY14SLC28A1SLC28A2
SCHEMBL19590310 0.84 DUT (0.36) DUTNT5EP2RY14SLC28A1SLC28A2
SCHEMBL18672122 0.84 DUT (0.36) DUTNT5EP2RY14P2RY2
SCHEMBL15281844 0.83 NT5E (0.36) DUTNT5EP2RY14SLC28A1SLC28A2
SCHEMBL15075485 0.83 DUT (0.38) DUTNT5EP2RY14
SCHEMBL29026465 0.81 DUT (0.37) DUTNT5E

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
US-9815864-B2 Substituted nucleosides, nucleotides and analogs thereof ALIOS BIOPHARMA, INC. (US) 2017-11-14 US disclosed