SCHEMBL2904043

SCHEMBL2904043

O=C(OC[C@H]1O[C@H](O)[C@H](OC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H]1F)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
LGALS9 O00182 1/20 0.45
LGALS1 P09382 1/20 0.45
LGALS3 P17931 1/20 0.45
LGALS7; LGALS7B P47929 1/20 0.45
ALDH1A1 P00352 3/20 0.44
LMNA P02545 1/20 0.42
PTPN1 P18031 1/20 0.42
MAPK1 P28482 2/20 0.41
GAA P10253 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
GAPDH P04406 1/20 0.38

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
SCHEMBL14210620 1.00 POLB (0.47) POLBKMT2AMEN1USP2LGALS9
SCHEMBL13211293 1.00 POLB (0.47) POLBKMT2AMEN1USP2LGALS9
SCHEMBL18490625 0.96 POLB (0.47) POLBKMT2AMEN1USP2LGALS9
SCHEMBL17612312 0.89 USP2 (0.56) POLBKMT2AMEN1USP2LGALS9
SCHEMBL13146097 0.89 USP2 (0.56) POLBKMT2AMEN1USP2LGALS9
SCHEMBL15481991 0.89 USP2 (0.56) POLBKMT2AMEN1USP2LGALS9
SCHEMBL5384438 0.89 USP2 (0.56) POLBKMT2AMEN1USP2LGALS9
SCHEMBL8153332 0.89 USP2 (0.56) POLBKMT2AMEN1USP2LGALS9
SCHEMBL8153327 0.89 USP2 (0.56) POLBKMT2AMEN1USP2LGALS9
SCHEMBL5384445 0.89 USP2 (0.56) POLBKMT2AMEN1USP2LGALS9

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
EP-2216337-A1 METHOD FOR PRODUCING 4-DEOXY-4-FLUORO-D-GLUCOSE DERIVATIVE Central Glass Company, Limited (JP) 2010-08-11 EP claimed
EP-2216337-A1 METHOD FOR PRODUCING 4-DEOXY-4-FLUORO-D-GLUCOSE DERIVATIVE Central Glass Company, Limited (JP) 2010-08-11 EP disclosed