SCHEMBL2157670

SCHEMBL2157670

CC(C)[O-].CC(C)[O-].CCOC(=O)CC(=O)C(F)(F)F.CCOC(=O)CC(=O)C(F)(F)F.[Ti+2]

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
TRPA1 O75762 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.35
LMNA P02545 1/20 0.35
FAAH O00519 5/20 0.33
TSHR P16473 1/20 0.33
MMP8 P22894 1/20 0.33
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ELANE P08246 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CES2 O00748 2/20 0.33
CES1 P23141 3/20 0.32

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
SCHEMBL5149685 0.93 GAA (0.56) GAAMGAMSIMGAM2TRPA1
SCHEMBL5148170 0.89 GAA (0.52) GAAMGAMSIMGAM2TRPA1
SCHEMBL77331 0.89 GAA (0.61) GAAMGAMSIMGAM2TRPA1
Water SCHEMBL10546276 0.87 GAA (0.58) GAAMGAMSIMGAM2TRPA1
SCHEMBL3265478 0.87 GAA (0.58) GAAMGAMSIMGAM2TRPA1
SCHEMBL7210415 0.87 GAA (0.58) GAAMGAMSIMGAM2TRPA1
SCHEMBL7406648 0.87 GAA (0.58) GAAMGAMSIMGAM2TRPA1
SCHEMBL1359716 0.81 GAA (0.44) GAAMGAMSIMGAM2TRPA1
SCHEMBL1360577 0.81 GAA (0.44) GAAMGAMSIMGAM2TRPA1
SCHEMBL25223809 0.79 GAA (0.54) GAAMGAMSIMGAM2TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1746135-B1 CURABLE COMPOSITION KANEKA CORP (JP) 2019-05-29 EP disclosed
EP-1749858-B1 CURABLE COMPOSITION KANEKA CORP (JP) 2019-04-03 EP disclosed
EP-1749857-B1 CURABLE COMPOSITION KANEKA CORP (JP) 2019-03-27 EP disclosed
US-7973108-B2 Curable composition KANEKA CORPORATION (JP) 2011-07-05 US disclosed
US-7763673-B2 Polyoxyalkylene glycol or a methacrylate polymer containing a crosslinkable silicon group; a titaniuim chelate of an alkyl acetoacetoate or derivative; and an amide wax thickener; highly curable KANEKA CORPORATION (JP) 2010-07-27 US disclosed
US-7625990-B2 Organic polymer having a silane tiol group, a titanium, aluminum or a zirconium catalyst, and a low molecular weight compound containing a hydrolyzable silicon group; sealants, adhesives KANEKA CORPORATION (JP) 2009-12-01 US disclosed
US-20080319152-A1 Curable Composition KANEKA CORPORATION (JP) 2008-12-25 US disclosed
US-20080287636-A1 Organic polymer having a silane tiol group, a titanium, aluminum or a zirconium catalyst, and a low molecular weight compound containing a hydrolyzable silicon group; sealants, adhesives KANEKA CORPORATION (JP) 2008-11-20 US disclosed
US-7446158-B2 Organic polymer having a silane tiol group, a titanium, aluminum or a zirconium catalyst, and a low molecular weight compound containing a hydrolyzable silicon group; sealants, adhesives KANEKA CORPORATION (JP) 2008-11-04 US disclosed
US-20080033087-A1 Polyoxyalkylene glycol or a methacrylate polymer containing a crosslinkable silicon group; a titaniuim chelate of an alkyl acetoacetoate or derivative; and an amide wax thickener; highly curable KANEKA CORPORATION (JP) 2008-02-07 US disclosed
US-20070219299-A1 Organic polymer having a silane tiol group, a titanium, aluminum or a zirconium catalyst, and a low molecular weight compound containing a hydrolyzable silicon group; sealants, adhesives KANEKA CORPORATION 2007-09-20 US disclosed
EP-1752496-A1 CURABLE COMPOSITION Kaneka Corporation (JP) 2007-02-14 EP disclosed
EP-1749857-A1 CURABLE COMPOSITION Kaneka Corporation (JP) 2007-02-07 EP disclosed
EP-1749858-A1 CURABLE COMPOSITION Kaneka Corporation (JP) 2007-02-07 EP disclosed
EP-1746135-A1 CURABLE COMPOSITION Kaneka Corporation (JP) 2007-01-24 EP disclosed