SCHEMBL9548604

SCHEMBL9548604

C[C@@]1(CO)O[C@H](n2ccc(=O)[nH]c2=O)CC1O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC28A1 O00337 1/20 0.46
SLC28A2 O43868 1/20 0.46
SLC29A1 Q99808 1/20 0.46
SLC28A3 Q9HAS3 1/20 0.46
DUT P33316 5/20 0.43
P2RY2 P41231 6/20 0.39
P2RY6 Q15077 4/20 0.39
P2RY4 P51582 3/20 0.39
P2RY14 Q15391 1/20 0.38
TK1 P04183 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
SCHEMBL9548602 1.00 SLC28A1 (0.46) SLC28A1SLC28A2SLC29A1SLC28A3DUT
SCHEMBL31653165 1.00 SLC28A1 (0.46) SLC28A1SLC28A2SLC29A1SLC28A3DUT
SCHEMBL18877290 0.87 SLC28A1 (0.46) SLC28A1SLC28A2SLC29A1SLC28A3DUT
SCHEMBL26135786 0.85 SLC28A1 (0.43) SLC28A1SLC28A2SLC29A1SLC28A3DUT
SCHEMBL26136394 0.85 SLC28A1 (0.43) SLC28A1SLC28A2SLC29A1SLC28A3DUT
SCHEMBL16647505 0.85 SLC28A1 (0.44) SLC28A1SLC28A2SLC29A1SLC28A3DUT
SCHEMBL17533911 0.83 SLC28A1 (0.41) SLC28A1SLC28A2SLC29A1SLC28A3DUT
SCHEMBL17534039 0.83 SLC28A1 (0.43) SLC28A1SLC28A2SLC29A1SLC28A3DUT
SCHEMBL5189630 0.83 SLC28A1 (0.43) SLC28A1SLC28A2SLC29A1SLC28A3DUT
SCHEMBL21063986 0.83 DUT (0.43) SLC28A1SLC28A2SLC29A1SLC28A3DUT

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-5192749-A Viricide, AIDS SYNTEX (U.S.A.) INC. (US) 1993-03-09 US disclosed