SCHEMBL2802204

SCHEMBL2802204

CC(=O)C(C(=O)c1cccs1)C(=O)C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
CES2 O00748 2/20 0.45
CES1 P23141 2/20 0.45
KEAP1 Q14145 1/20 0.45
DAO P14920 1/20 0.42
ALDH1A1 P00352 5/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
HDAC1 Q13547 1/20 0.40
CTNNB1 P35222 1/20 0.39
WNT3A P56704 1/20 0.39

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
SCHEMBL4581429 0.83 CYP2C9 (0.46) TSHRCYP2D6CYP2C9CYP2C19CES2
SCHEMBL3249145 0.81 CYP2C9 (0.52) TSHRCYP2D6CYP2C9CYP2C19CES2
SCHEMBL11754964 0.80 DAO (0.52) TSHRCYP2D6CYP2C9CYP2C19CES2
SCHEMBL1681118 0.80 TSHR (0.51) TSHRCYP2D6CYP2C9CYP2C19CES2
SCHEMBL28376224 0.79 TSHR (0.50) TSHRCYP2D6CYP2C9CYP2C19CES2
SCHEMBL5873224 0.78 TSHR (0.49) TSHRCYP2D6CYP2C9CYP2C19CES2
SCHEMBL27427456 0.77 CYP2C9 (0.49) TSHRCYP2D6CYP2C9CYP2C19CES2
SCHEMBL10628291 0.76 TSHR (0.48) TSHRCYP2D6CYP2C9CYP2C19CES2
SCHEMBL5873170 0.75 CYP2C19 (0.47) TSHRCYP2D6CYP2C9CYP2C19CES2
SCHEMBL11208250 0.75 CES2 (0.51) TSHRCYP2D6CYP2C9CYP2C19CES2

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 75 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150143954-A1 SYSTEM AND METHOD FOR SELECTIVELY REMOVING METALS FROM INDUSTRIAL WASTE NEUMANN SYSTEMS GROUP INC (US) 2015-05-28 US claimed
WO-2013177583-A2 SYSTEM AND METHOD FOR SELECTIVELY REMOVING METALS FROM INDUSTRIAL WASTE NEUMANN SYSTEMS GROUP, INC. (US) 2013-11-28 WO claimed
US-20070054823-A1 Removal of post etch residues and copper contamination from low-K dielectrics using supercritical CO2 with diketone additives EKC TECHNOLOGY, INC. 2007-03-08 US claimed
EP-1673802-A1 REMOVAL OF POST ETCH RESIDUES AND COPPER CONTAMINATION FROM LOW-K DIELECTRICS USING SUPERCRITICAL CO sb 2 /sb WITH DIKETONE ADDITIVES EKC Technology, INC. (US) 2006-06-28 EP claimed
US-20050107274-A1 Removal of post etch residues and copper contamination from low-k dielectrics using supercritical CO2 with diketone additives EKC TECHNOLOGY, INC. 2005-05-19 US claimed
WO-2005038898-A1 REMOVAL OF POST ETCH RESIDUES AND COPPER CONTAMINATION FROM LOW-K DIELECTRICS USING SUPERCRITICAL CO2 WITH DIKETONE ADDITIVES EKC TECHNOLOGY, INC. (US) 2005-04-28 WO claimed
JP-2003524699-A 2003-08-19 JP claimed
EP-1019553-B1 METHOD FOR DISSOCIATING METALS OR DISSOCIATING METAL COMPOUNDS IDAHO RES FOUND (US) 2003-05-28 EP claimed
EP-0762918-B1 FLUID EXTRACTION OF METALS AND/OR METALLOIDS IDAHO RES FOUND (US) 2002-08-28 EP claimed
US-6132491-A TREATING A SUPERCRITICAL FLUID INCLUDING METAL COMPOUNDS WITH HEAT AND/OR REDUCING OR OXIDIZING AGENTS TO DISSOCIATE THE METAL FROM THE COMPOUNDS IN THE SUPERCRITICAL FLUID AND FORM METAL OR METAL OXIDE; PURE PRODUCTS IDAHO RESEARCH FOUNDATION, INC. (US) 2000-10-17 US claimed
EP-1019553-A1 METHOD FOR DISSOCIATING METALS OR DISSOCIATING METAL COMPOUNDS IDAHO RESEARCH FOUNDATION, INC. (US) 2000-07-19 EP claimed
WO-1999009223-A1 METHOD FOR DISSOCIATING METALS OR DISSOCIATING METAL COMPOUNDS IDAHO RESEARCH FOUNDATION, INC. (US) 1999-02-25 WO claimed
EP-0873429-A1 EXTRACTING METALS DIRECTLY FROM METAL OXIDES IDAHO RESEARCH FOUNDATION, INC. (US) 1998-10-28 EP claimed
US-5730874-A Extraction of metals using supercritical fluid and chelate forming legand IDAHO RESEARCH FOUNDATION, INC. (US) 1998-03-24 US claimed
WO-1997016575-A9 EXTRACTING METALS DIRECTLY FROM METAL OXIDES 1997-08-07 WO claimed
CN-1152260-A Fluid extraction of metal and/or metalloid IDAHO RES FOUND (US) 1997-06-18 CN claimed
WO-1997016575-A1 EXTRACTING METALS DIRECTLY FROM METAL OXIDES IDAHO RESEARCH FOUNDATION, INC. (US) 1997-05-09 WO claimed
EP-0762918-A1 FLUID EXTRACTION OF METALS AND/OR METALLOIDS IDAHO RESEARCH FOUNDATION, INC. (US) 1997-03-19 EP claimed
US-5606724-A EXPOSING OXIDE TO SUPERCRITICAL FLUID SOLVENT CONTAINING CHELATING AGENT IDAHO RESEARCH FOUNDATION, INC. (US) 1997-02-25 US claimed
WO-1995033541-A1 FLUID EXTRACTION OF METALS AND/OR METALLOIDS IDAHO RESEARCH FOUNDATION, INC. (US) 1995-12-14 WO claimed