SCHEMBL4619978

SCHEMBL4619978

CCCCCCCCCCCCCCCCOc1ccc(S(OS(=O)(=O)C(F)(F)F)(c2ccc(OCCCCCCCCCCCCCCCC)cc2)c2ccc(OCCCCCCCCCCCCCCCC)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.51
CA1 P00915 4/20 0.51
CA2 P00918 4/20 0.51
CA9 Q16790 4/20 0.51
TSHR P16473 3/20 0.51
CA7 P43166 2/20 0.51
TP53 P04637 1/20 0.49
PLA2G4B P0C869 4/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
NR5A1 Q13285 1/20 0.46
RARB P10826 3/20 0.46
LTA4H P09960 1/20 0.45
MAPK1 P28482 1/20 0.44
RECQL P46063 1/20 0.44
PLA2G4A P47712 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL4620795 1.00 CA12 (0.51) CA12CA1CA2CA9TSHR
SCHEMBL4620130 0.96 LTA4H (0.49) CA12CA1CA2CA9TSHR
SCHEMBL4620192 0.96 LTA4H (0.49) CA12CA1CA2CA9TSHR
SCHEMBL3144095 0.92 TSHR (0.51) CA12CA1CA2CA9TSHR
SCHEMBL5856347 0.83 CA12 (0.54) CA12CA1CA2CA9TSHR
SCHEMBL5856147 0.83 CA12 (0.54) CA12CA1CA2CA9TSHR
SCHEMBL6310046 0.81 CA1 (0.49) CA12CA1CA2CA9TSHR
SCHEMBL17795365 0.81 PTPRZ1 (0.59) CA12CA1CA2CA9TSHR
SCHEMBL3104520 0.80 CA1 (0.45) CA12CA1CA2CA9TSHR
SCHEMBL3130573 0.79 CA1 (0.44) CA12CA1CA2CA9TSHR

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
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
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