SCHEMBL1857461

SCHEMBL1857461

CCCCCCCCCN1CC(O)C(O)C(O)C(O)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GUSB P08236 2/20 1.00
GLB1 P16278 1/20 0.77
GBA1 P04062 10/20 0.74
GBA2 Q9HCG7 12/20 0.59
GAA P10253 2/20 0.59
UGCG Q16739 1/20 0.59

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
SCHEMBL2272922 1.00 GUSB (1.00) GUSBGLB1GBA1GBA2GAA
SCHEMBL2268517 1.00 GUSB (1.00) GUSBGLB1GBA1GBA2GAA
SCHEMBL3378221 0.96 GUSB (0.92) GUSBGLB1GBA1GBA2GAA
SCHEMBL15599059 0.96 GUSB (0.92) GUSBGLB1GBA1GBA2GAA
SCHEMBL2430985 0.96 GUSB (0.92) GUSBGLB1GBA1GBA2GAA
SCHEMBL2430986 0.96 GUSB (0.92) GUSBGLB1GBA1GBA2GAA
SCHEMBL15599026 0.96 GUSB (0.92) GUSBGLB1GBA1GBA2GAA
SCHEMBL15599058 0.96 GUSB (0.92) GUSBGLB1GBA1GBA2GAA
SCHEMBL2435897 0.96 GUSB (0.92) GUSBGLB1GBA1GBA2GAA
SCHEMBL2430983 0.96 GUSB (0.92) GUSBGLB1GBA1GBA2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2323651-A2 COMPOUNDS FOR THE TREATMENT OF FLAVIVIRAL INFECTIONS Summit Corporation Plc (GB) 2011-05-25 EP disclosed
WO-2010049678-A2 TREATMENT OF ENERGY UTILIZATION DISEASES SUMMIT CORPORATION PLC (GB) 2010-05-06 WO disclosed
WO-2010029313-A1 ANTIINFECTIVE COMPOUNDS SUMMIT CORPORATION PLC. (GB) 2010-03-18 WO disclosed
WO-2010015815-A2 COMPOUNDS FOR THE TREATMENT OF FLAVIVIRAL INFECTIONS SUMMIT CORPORATION PLC (GB) 2010-02-11 WO disclosed