SCHEMBL8909630

SCHEMBL8909630

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

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DUT P33316 1/20 0.57
SLC28A1 O00337 1/20 0.51
SLC28A2 O43868 1/20 0.51
SLC29A1 Q99808 1/20 0.51
SLC28A3 Q9HAS3 1/20 0.51
P2RY6 Q15077 10/20 0.51
P2RY14 Q15391 4/20 0.51
P2RY2 P41231 13/20 0.50
P2RY4 P51582 6/20 0.50

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
SCHEMBL6060488 0.90 SLC28A1 (0.63) DUTSLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL9218570 0.90 SLC28A1 (0.63) DUTSLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL2762704 0.90 SLC28A1 (0.63) DUTSLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL21078688 0.90 SLC28A1 (0.63) DUTSLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL15866629 0.88 DUT (0.58) DUTSLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL21089328 0.88 DUT (0.57) DUTSLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL10521044 0.88 DUT (0.57) DUTSLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL19861744 0.88 DUT (0.57) DUTSLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL25399227 0.87 DUT (0.56) DUTSLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL21089723 0.87 DUT (0.56) DUTSLC28A1SLC28A2SLC29A1SLC28A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5631239-A VIRICIDES FOR HEPATITIS YALE UNIVERSITY (US) 1997-05-20 US disclosed
US-5627160-A L-2',3'-dideoxy nucleoside analogs as anti-hepatitis B (HBV) and anti-HIV agents YALE UNIVERSITY (US) 1997-05-06 US disclosed
US-5561120-A LOW TOXICITY TO HOST CELLS YALE UNIVERSITY (US) 1996-10-01 US disclosed