SCHEMBL25329700

SCHEMBL25329700

[CH2]C1OC(n2ccc(=O)[nH]c2=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
SLC28A1 O00337 1/20 0.45
SLC28A2 O43868 1/20 0.45
SLC29A1 Q99808 1/20 0.45
SLC28A3 Q9HAS3 1/20 0.45
P2RY2 P41231 9/20 0.41
P2RY6 Q15077 7/20 0.41
LMNA P02545 1/20 0.41
THRB P10828 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HIF1A Q16665 1/20 0.41
P2RY4 P51582 3/20 0.40
P2RY14 Q15391 1/20 0.39

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
SCHEMBL25924676 0.82 SLC28A1 (0.62) TDP1SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL26644222 0.82 SLC28A1 (0.62) TDP1SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL15497392 0.82 SLC28A1 (0.52) TDP1SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL2921711 0.82 SLC28A1 (0.62) TDP1SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL15276409 0.82 SLC28A1 (0.52) TDP1SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL16452370 0.82 SLC28A1 (0.52) TDP1SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL6226229 0.82 SLC28A1 (0.62) TDP1SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL13018205 0.82 SLC28A1 (0.52) TDP1SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL6545745 0.82 SLC28A1 (0.62) TDP1SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL18852608 0.82 SLC28A1 (0.52) TDP1SLC28A1SLC28A2SLC29A1SLC28A3

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
WO-2023142803-A1 ANTIVIRAL COMPOUND AND USE THEREOF 北京恩泰伟医药科技有限公司 2023-08-03 WO disclosed