SCHEMBL7640960

SCHEMBL7640960

COC(=O)[C@@H](S)[C@@H](S)C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.48
CA14 Q9ULX7 2/20 0.40
ALDH1A1 P00352 4/20 0.39
KMT2A Q03164 2/20 0.37
CA12 O43570 1/20 0.37
HSD17B10 Q99714 3/20 0.37
HPGD P15428 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
ABCB11 O95342 1/20 0.37
F2 P00734 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
DUSP3 P51452 1/20 0.37
PTPN5 P54829 1/20 0.37
PTPN11 Q06124 1/20 0.37
LMNA P02545 1/20 0.37
CYP2C9 P11712 1/20 0.37
HIF1A Q16665 1/20 0.37

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
SCHEMBL10329462 1.00 SMN1; SMN2 (0.48) SMN1; SMN2CA14ALDH1A1KMT2ACA12
SCHEMBL29064781 0.88
SCHEMBL10329475 0.85 SMN1; SMN2 (0.44) SMN1; SMN2CA14ALDH1A1KMT2ACA12
SCHEMBL2138019 0.85
SCHEMBL8313441 0.81 SMN1; SMN2 (0.34) SMN1; SMN2CA14ALDH1A1
SCHEMBL5755090 0.80
SCHEMBL2035273 0.80 SMN1; SMN2 (0.48) SMN1; SMN2CA14ALDH1A1KMT2ACA12
SCHEMBL14574445 0.79 SMN1; SMN2 (0.39) SMN1; SMN2CA14ALDH1A1KMT2ACA12
SCHEMBL11574487 0.79 SMN1; SMN2 (0.37) SMN1; SMN2CA14KMT2ACA12
SCHEMBL932508 0.78

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
US-6468688-B2 CHARGING, DISCHARGING EFFICIENCY; VANADIUM ELECTROLYTE PINNACLE VRB LIMITED (AU) 2002-10-22 US disclosed
US-20010028977-A1 Charging, discharging efficiency; vanadium electrolyte JD HOLDING INC. (KY) 2001-10-11 US disclosed
EP-0829104-A1 HIGH ENERGY DENSITY VANADIUM ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND ALL-VANADIUM REDOX CELLS AND BATTERIES CONTAINING HIGH ENERGY VANADIUM ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1998-03-18 EP disclosed
WO-1996035239-A1 HIGH ENERGY DENSITY VANADIUM ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND ALL-VANADIUM REDOX CELLS AND BATTERIES CONTAINING HIGH ENERGY VANADIUM ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1996-11-07 WO disclosed