SCHEMBL7156228

SCHEMBL7156228

CC1(C)O[C@H]2O[C@H](COC(c3ccccc3)(c3ccccc3)c3ccccc3)C(=O)[C@H]2O1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.37
MAPK1 P28482 1/20 0.37
ALDH1A1 P00352 2/20 0.36
TYMP P19971 6/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HSP90AA1 P07900 1/20 0.33
KIF11 P52732 1/20 0.33
ELANE P08246 1/20 0.32
TK1 P04183 1/20 0.32
POLB P06746 1/20 0.30
HPGD P15428 1/20 0.30
ATM Q13315 1/20 0.30
TK2 O00142 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
SCHEMBL12111912 0.85 CYP3A4 (0.37) CYP3A4MAPK1ALDH1A1MEN1KMT2A
SCHEMBL29557740 0.79 ALDH1A1 (0.35) CYP3A4MAPK1ALDH1A1TYMPMEN1
SCHEMBL9374505 0.78 OPRM1 (0.40) ALDH1A1POLB
SCHEMBL14414820 0.78 OPRM1 (0.40) ALDH1A1POLB
SCHEMBL20285415 0.78 OPRM1 (0.40) ALDH1A1POLB
SCHEMBL21682012 0.77 SMYD2 (0.39) CYP3A4ALDH1A1
SCHEMBL17198303 0.77 SMYD2 (0.39) CYP3A4ALDH1A1
SCHEMBL7850077 0.76 ALDH1A1 (0.60) MAPK1ALDH1A1KMT2APOLBHPGD
SCHEMBL12556315 0.76 ALDH1A1 (0.60) MAPK1ALDH1A1KMT2APOLBHPGD
SCHEMBL13672341 0.76 ALDH1A1 (0.60) MAPK1ALDH1A1KMT2APOLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3999118-A1 ANTIBODY-STING AGONIST CONJUGATES AND THEIR USE IN IMMUNOTHERAPY Immunesensor Therapeutics, Inc. (US) 2022-05-25 EP disclosed
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
US-6143443-A ALL-VANADIUM REDOX BATTERY, COMPRISING THE STABILIZED ELECTROLYTE PINNACLE ARB LIMITED (AU) 2000-11-07 US disclosed
US-4133817-A 11-Oxa-prostaglandin analogs CHEMBRO HOLDINGS (PROPRIETARY) LIMITED (ZA) 1979-01-09 US disclosed