SCHEMBL6574209

SCHEMBL6574209

CCCCCO[C@H]1O[C@H](C)[C@@H](OCCCCC)[C@H]1OCCCCC

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 5/20 0.46
FGF1 P05230 3/20 0.39
FGF2 P09038 3/20 0.39
VEGFA P15692 3/20 0.39
HPSE Q9Y251 3/20 0.39
TNF P01375 1/20 0.36
MAPK1 P28482 2/20 0.35
RECQL P46063 2/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
EPHX2 P34913 1/20 0.33
BLM P54132 1/20 0.33
PTAFR P25105 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GJB2 P29033 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
SCHEMBL8992926 1.00 GBA1 (0.46) GBA1FGF1FGF2VEGFAHPSE
SCHEMBL6574204 1.00 GBA1 (0.46) GBA1FGF1FGF2VEGFAHPSE
SCHEMBL8992784 0.89 TNF (0.46) GBA1FGF1FGF2VEGFAHPSE
SCHEMBL8992782 0.89 TNF (0.46) GBA1FGF1FGF2VEGFAHPSE
SCHEMBL9506020 0.86 GBA1 (0.41) GBA1FGF1FGF2VEGFAHPSE
SCHEMBL9506027 0.86 GBA1 (0.41) GBA1FGF1FGF2VEGFAHPSE
SCHEMBL3344916 0.85 GBA1 (0.38) GBA1FGF1FGF2VEGFAHPSE
SCHEMBL3344912 0.85 GBA1 (0.38) GBA1FGF1FGF2VEGFAHPSE
SCHEMBL3345485 0.82 BCHE (0.41) GBA1TNFMAPK1TSHRALDH1A1
SCHEMBL3345490 0.82 BCHE (0.41) GBA1TNFMAPK1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0021231-B1 PROCESS FOR THE PREPARATION OF 5'-DEOXY-5-FLUORO URIDINE AND INTERMEDIATES IN THIS PROCESS F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1983-10-05 EP claimed
JP-2004123758-A NOVEL METHOD FOR PRODUCING N4-ACYL-5'-DEOXY-5-FLUOROCYTIDINE DERIVATIVE F HOFFMANN LA ROCHE AG 2004-04-22 JP disclosed
EP-0602478-B1 Novel process for producing N4-acyl-5'-deoxy-5-fluorocytidine derivatives HOFFMANN LA ROCHE (CH) 1996-07-31 EP disclosed
EP-0602478-A1 Novel process for producing N4-acyl-5'-deoxy-5-fluorocytidine derivatives F. HOFFMANN-LA ROCHE AG (CH) 1994-06-22 EP disclosed
EP-0602478-A1 Novel process for producing N4-acyl-5'-deoxy-5-fluorocytidine derivatives F. HOFFMANN-LA ROCHE AG (CH) 1994-06-22 EP disclosed
EP-0021231-B1 PROCESS FOR THE PREPARATION OF 5'-DEOXY-5-FLUORO URIDINE AND INTERMEDIATES IN THIS PROCESS F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1983-10-05 EP disclosed
US-4340729-A 5'-Deoxy-5-fluorouridine HOFFMANN-LA ROCHE INC. (US) 1982-07-20 US disclosed