SCHEMBL5683256

SCHEMBL5683256

O=c1ccn(NC(O)[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)c(=O)[nH]1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.35
SLC28A1 O00337 1/20 0.34
SLC28A2 O43868 1/20 0.34
SLC29A1 Q99808 1/20 0.34
SLC28A3 Q9HAS3 1/20 0.34
DUT P33316 5/20 0.33
CRBN Q96SW2 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
PKM P14618 1/20 0.32
DDB1 Q16531 1/20 0.31
POLB P06746 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL19137754 0.79 DUT (0.36) LMNAALDH1A1SLC28A1SLC28A2SLC29A1
SCHEMBL11389897 0.72 CRBN (0.46) LMNAALDH1A1DUTCRBNPKM
SCHEMBL7926412 0.70 PKM (0.40) LMNAALDH1A1DUTCRBNPKM
SCHEMBL7632468 0.67 CRBN (0.47) LMNAALDH1A1DUTCRBNPKM
SCHEMBL23171170 0.64 POLB (0.44) LMNAALDH1A1SLC28A1SLC28A2SLC29A1
SCHEMBL2181554 0.63 CRBN (0.54) LMNAALDH1A1DUTCRBNPKM
SCHEMBL3541014 0.63 CRBN (0.54) LMNAALDH1A1DUTCRBNPKM
SCHEMBL14237174 0.62 POLB (0.45) LMNAALDH1A1SLC28A1SLC28A2SLC29A1
SCHEMBL9019445 0.62 CRBN (0.44) LMNAALDH1A1DUTCRBNDDB1
SCHEMBL338055 0.59 ALDH1A1 (0.56) LMNAALDH1A1DUTCRBNPKM

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-1492842-B1 COMPOUNDS USEFUL FOR REDUCING ACETALDEHYDE CONTENT OF POLYETHYLENE TEREPHTHALATE, THEIR USE AND PRODUCTS RESULTING THEREFROM EQUIPOLYMERS GMBH (DE) 2006-04-12 EP disclosed