SCHEMBL4619945

SCHEMBL4619945

CCCCCCCCCCCCCCCCCCOc1ccc([I+]C)c(Cc2ccccc2)c1.F[B-](F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 3/20 0.44
LTA4H P09960 1/20 0.43
DHFR P00374 7/20 0.42
PLA2G4B P0C869 1/20 0.41
TSHR P16473 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
THRA P10827 1/20 0.39
PDK2 Q15119 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
SCHEMBL4619246 0.89 PTPN11 (0.43) PTPN11LTA4HDHFRPLA2G4BTSHR
Trifluoromethanesulfonic Acid SCHEMBL4620311 0.87 PDK2 (0.40) PTPN11LTA4HDHFRPLA2G4BMTNR1A
SCHEMBL7624249 0.83 PTPN11 (0.48) PTPN11LTA4HDHFRPLA2G4BTSHR
SCHEMBL4619477 0.83 PTPN11 (0.45) PTPN11LTA4HDHFRPLA2G4BTSHR
Trifluoromethanesulfonic Acid SCHEMBL4617899 0.79 PDK2 (0.39) PTPN11DHFRPLA2G4BMTNR1AMTNR1B
SCHEMBL18854866 0.73 L3MBTL1 (0.68) LTA4HPLA2G4BTSHRL3MBTL1
SCHEMBL18995913 0.73 L3MBTL1 (0.68) LTA4HPLA2G4BTSHRL3MBTL1
SCHEMBL18854865 0.73 L3MBTL1 (0.68) LTA4HPLA2G4BTSHRL3MBTL1
SCHEMBL28676091 0.73 L3MBTL1 (0.68) LTA4HPLA2G4BTSHRL3MBTL1
SCHEMBL570564 0.71 L3MBTL1 (0.70) LTA4HL3MBTL1

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-1889862-A1 Curable resin composition, process for producing the same, and coated object made with the same DAICEL CHEMICAL INDUSTRIES, Ltd. (JP) 2008-02-20 EP disclosed
EP-1172393-B1 CURABLE RESIN COMPOSITION, PROCESS FOR PRODUCING THE SAME, AND COATED OBJECT MADE WITH THE SAME DAICEL CHEM (JP) 2007-10-31 EP disclosed
US-6924008-B2 Curable resin composition, a method for the preparation thereof, and a coated article thereof DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2005-08-02 US disclosed
US-20030032729-A1 Curable resin composition, process for producing the same, and coated object made with the same DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-02-13 US disclosed
US-6437090-B1 ORGANOMETALLIC COMPOUND CAPABLE OF REVERSIBLY DISSOLVING AND PRECIPITATING THROUGH HEATING AND COOLING; ORGANOSILICON COMPOUND; ONE LIGAND CONTAINS AN ALKYL GROUP HAVING 10 OR MORE CARBON ATOMS; EPOXY RESIN; STORAGE STABLE; ONLY CURES ON HEAT KABUSHIKI KAISHA TOSHIBA (JP) 2002-08-20 US disclosed
EP-1172393-A1 CURABLE RESIN COMPOSITION, PROCESS FOR PRODUCING THE SAME, AND COATED OBJECT MADE WITH THE SAME DAICEL CHEMICAL INDUSTRIES, Ltd. (JP) 2002-01-16 EP disclosed