SCHEMBL17732004

SCHEMBL17732004

CC1(CO)COB(c2ccc(CO)cc2)OC1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.39
LPL P06858 5/20 0.37
LIPG Q9Y5X9 5/20 0.37
F11 P03951 1/20 0.36
SNCA P37840 1/20 0.32
ESR2 Q92731 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
SCHEMBL15293463 0.86 SNCA (0.40) LPLLIPGF11SNCAESR2
SCHEMBL10136962 0.83 EPHX1 (0.42) EPHX1LPLLIPG
SCHEMBL14986008 0.76 TSHR (0.37) LPLLIPGF11
SCHEMBL1285032 0.73 LIPG (0.65) LPLLIPGF11ESR2
SCHEMBL14986010 0.73 CHKA (0.35) LPLLIPGF11
SCHEMBL19865291 0.70 LPL (0.43) LPLLIPGF11SNCAESR2
SCHEMBL12335857 0.70 CHKA (0.44) LPLLIPG
SCHEMBL14986014 0.69 PRSS1 (0.43) LPLLIPGF11
SCHEMBL4264297 0.69 SNCA (0.44) LPLLIPGF11SNCA
SCHEMBL3871815 0.69 SNCA (0.40) LPLLIPGF11SNCAESR2

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
WO-2016073357-A1 NOVEL HYDROGEN PEROXIDE-ACTIVABLE, ANTI-OXIDANT COMPOUNDS AND METHODS USING SAME BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2016-05-12 WO claimed
WO-2023048453-A1 NANOPARTICLES COMPRISING DRUG DIMERS, AND USE THEREOF (주) 테라베스트 2023-03-30 WO disclosed
US-10370391-B2 Hydrogen peroxide-activable, anti-oxidant compounds and methods using same BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2019-08-06 US disclosed
US-20180105540-A1 NOVEL HYDROGEN PEROXIDE-ACTIVABLE, ANTI-OXIDANT COMPOUNDS AND METHODS USING SAME BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2018-04-19 US disclosed
WO-2016073357-A1 NOVEL HYDROGEN PEROXIDE-ACTIVABLE, ANTI-OXIDANT COMPOUNDS AND METHODS USING SAME BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2016-05-12 WO disclosed