SCHEMBL2496191

SCHEMBL2496191

CC(COP(=O)(O)O)c1cccc2c1N(O)c1ccccc1S2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 12/20 0.38
PTGS1 P23219 2/20 0.37
PTGS2 P35354 2/20 0.37
NOX1 Q9Y5S8 1/20 0.37
CYP2D6 P10635 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
POLB P06746 1/20 0.35
ATM Q13315 1/20 0.35
MAPT P10636 2/20 0.35
ACHE P22303 1/20 0.35
HTR1A P08908 1/20 0.34
ADRB3 P13945 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
DRD3 P35462 1/20 0.34
HTR2B P41595 1/20 0.34
HTR6 P50406 1/20 0.34
HTT P42858 1/20 0.34
FNTA P49354 1/20 0.34

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
SCHEMBL5070736 0.90 BCHE (0.37) BCHEPTGS1PTGS2NOX1CYP2D6
SCHEMBL4080952 0.84 BCHE (0.40) BCHEPTGS1PTGS2NOX1CYP2D6
SCHEMBL4079882 0.80 PTGS1 (0.44) BCHEPTGS1PTGS2NOX1CYP2D6
SCHEMBL5073280 0.77 BCHE (0.40) BCHEPTGS1PTGS2NOX1CYP2D6
SCHEMBL5566417 0.75 BCHE (0.44) BCHEPTGS1PTGS2NOX1CYP2D6
SCHEMBL7620961 0.74 PTGS1 (0.43) BCHEPTGS1PTGS2NOX1CYP2D6
SCHEMBL7617079 0.70 BCHE (0.42) BCHENOX1MAPTHTR1AADRB3
SCHEMBL4343072 0.68 NOX1 (0.39) BCHENOX1POLBATMACHE
SCHEMBL4088074 0.66 BCHE (0.38) BCHENOX1MAPTACHEHTR1A
Phosphoric Acid SCHEMBL6395405 0.65 MEN1 (0.48) BCHENOX1CYP2D6CYP2C19POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7270880-B2 Electrochromic particles NTERA LIMITED (IE) 2007-09-18 US claimed
US-20060097233-A1 Electrochromic particles NTERA LIMITED (IE) 2006-05-11 US claimed
US-20050128562-A1 Nanoporous and nanocrystalline film and electrochromic device UNIVERSITY COLLEGE DUBLIN, A CONSTITUENT COLLEGE OF THE NATIONAL UNIVERSITY OF IRELAND 2005-06-16 US claimed
EP-1224505-B1 ELECTROCHROMIC DEVICE UNIV DUBLIN (IE) 2005-01-12 EP claimed
US-8030832-B2 Method for preparing electrode system, electrode system prepared therefrom, and electric device comprising the same LG CHEM, LTD. (KR) 2011-10-04 US disclosed
US-7358358-B2 Electrochromic compound NTERA LIMITED (IE) 2008-04-15 US disclosed
US-7358358-B2 Electrochromic compound NTERA LIMITED (IE) 2008-04-15 US disclosed
EP-1673827-A1 METHOD FOR PREPARING ELECTRODE SYSTEM, ELECTRODE SYSTEM PREPARED THEREFROM, AND ELECTRIC DEVICE COMPRISING THE SAME LG Chem, LTD. LG Twin Tower (KR) 2006-06-28 EP disclosed
US-20060097233-A1 Electrochromic particles NTERA LIMITED (IE) 2006-05-11 US disclosed
US-20050128562-A1 Nanoporous and nanocrystalline film and electrochromic device UNIVERSITY COLLEGE DUBLIN, A CONSTITUENT COLLEGE OF THE NATIONAL UNIVERSITY OF IRELAND 2005-06-16 US disclosed
US-20050117194-A1 Method for preparing electrode system, electrode system prepared therefrom, and electric device comprising the same LG CHEM, LTD. (KR) 2005-06-02 US disclosed
WO-2005036681-A1 METHOD FOR PREPARING ELECTRODE SYSTEM, ELECTRODE SYSTEM PREPARED THEREFROM, AND ELECTRIC DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2005-04-21 WO disclosed
EP-1224505-A1 ELECTROCHROMIC DEVICE UNIVERSITY COLLEGE DUBLIN (IE) 2002-07-24 EP disclosed
WO-2001027690-A2 ELECTROCHROMIC DEVICE UNIVERSITY COLLEGE DUBLIN (IE) 2001-04-19 WO disclosed