SCHEMBL7150801

SCHEMBL7150801

CC1(C)O[C@H]2O[C@H]3[C@H](OC(c4ccccc4)O[C@@H]3CF)[C@H]2O1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
GLB1 P16278 1/20 0.36
CA2 P00918 2/20 0.32
CA1 P00915 1/20 0.32
CA9 Q16790 1/20 0.32
HPGD P15428 2/20 0.32
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 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
SCHEMBL7150901 0.88 ALDH1A1 (0.44) ALDH1A1GLB1CA2HPGDMEN1
SCHEMBL7991319 0.88 ALDH1A1 (0.44) ALDH1A1GLB1CA2HPGDMEN1
SCHEMBL7987844 0.88 ALDH1A1 (0.44) ALDH1A1GLB1CA2HPGDMEN1
SCHEMBL19987642 0.88 ALDH1A1 (0.44) ALDH1A1GLB1CA2HPGDMEN1
SCHEMBL31571169 0.88 ALDH1A1 (0.44) ALDH1A1GLB1CA2HPGDMEN1
SCHEMBL18121287 0.88 ALDH1A1 (0.44) ALDH1A1GLB1CA2HPGDMEN1
SCHEMBL20033544 0.88 ALDH1A1 (0.44) ALDH1A1GLB1CA2HPGDMEN1
SCHEMBL11301737 0.86 ALDH1A1 (0.48) ALDH1A1GLB1CA2CA1CA9
SCHEMBL7151063 0.82 ALDH1A1 (0.45) ALDH1A1GLB1CA2CA1CA9
SCHEMBL18121282 0.81 ALDH1A1 (0.47) ALDH1A1GLB1CA2CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6562514-B1 Stabilized vanadium electrolyte solutions for all-vanadium redox cells and batteries PINNACLE VRB LIMITED (AU) 2003-05-13 US disclosed
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