SCHEMBL25711972

SCHEMBL25711972

CC(CO)OC(CN)n1ccc(=O)[nH]c1=O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ PKM P14618 1/20 0.37
▸ CRBN Q96SW2 3/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ DUT P33316 7/20 0.33
▸ SLC28A1 O00337 1/20 0.31
▸ SLC28A2 O43868 1/20 0.31
▸ SLC29A1 Q99808 1/20 0.31
▸ SLC28A3 Q9HAS3 1/20 0.31
▸ CA1 P00915 1/20 0.30
▸ CA2 P00918 1/20 0.30
▸ CA4 P22748 1/20 0.30
▸ CA9 Q16790 1/20 0.30
▸ DDB1 Q16531 1/20 0.30

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
SCHEMBL20407952 0.90 POLB (0.55) POLBHSD17B10PKMCRBNALDH1A1
SCHEMBL20052004 0.90 POLB (0.55) POLBHSD17B10PKMCRBNALDH1A1
SCHEMBL14143203 0.88 POLB (0.47) POLBHSD17B10PKMCRBNALDH1A1
SCHEMBL13896528 0.81 POLB (0.52) POLBHSD17B10PKMCRBNALDH1A1
SCHEMBL20052005 0.78 POLB (0.72) POLBHSD17B10ALDH1A1LMNADUT
SCHEMBL25712429 0.78 P2RY2 (0.44) —
SCHEMBL25583964 0.77 POLB (0.52) POLBHSD17B10PKMCRBNALDH1A1
SCHEMBL23710654 0.76 POLB (0.52) POLBHSD17B10PKMCRBNALDH1A1
SCHEMBL19303349 0.76 POLB (0.52) POLBHSD17B10PKMCRBNALDH1A1
SCHEMBL13471838 0.76 POLB (0.52) POLBHSD17B10PKMCRBNALDH1A1

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-3131914-B1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS LLC (US) 2023-05-10 — — EP disclosed
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