SCHEMBL8429073

SCHEMBL8429073

C#C[C@@]1(OC(=O)OCC)[C@@H](COC(=O)c2ccc(Cl)cc2)OC(OC(=O)OCC)[C@@H]1OC(=O)OCC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.35
▸ CHRNB2 P17787 1/20 0.34
▸ CHRNA5 P30532 1/20 0.34
▸ CHRNA7 P36544 1/20 0.34
▸ CHRNA4 P43681 1/20 0.34
▸ UPP1 Q16831 1/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ MAPT P10636 4/20 0.32
▸ ABCC1 P33527 1/20 0.32
▸ GAPDH P04406 1/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL7038041 0.84 UPP1 (0.39) POLBCHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL7037404 0.84 HPGD (0.40) POLBCHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL7031856 0.84 POLB (0.35) POLBCHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL7035707 0.83 POLB (0.36) POLBCHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL7037180 0.82 UPP1 (0.37) POLBCHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL7037656 0.82 NT5E (0.38) POLBMEN1KMT2AGAPDH
SCHEMBL7038066 0.81 MEN1 (0.41) POLBCHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL7030197 0.77 ALDH1A1 (0.44) UPP1MEN1KMT2ACYP1A2CYP2C19
SCHEMBL7161077 0.73 ALDH1A1 (0.39) CHRNB2CHRNA5CHRNA7CHRNA4NPC1
SCHEMBL7035235 0.72 HPGD (0.39) POLBCHRNB2CHRNA5CHRNA7CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5880294-A D-pentofuranose derivatives and process for preparing the same TAIHO PHARMACEUTICAL CO., LTD. (JP) 1999-03-09 — — US disclosed
EP-0842942-A1 D-PENTOFURANOSE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 1998-05-20 — — EP disclosed
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