SCHEMBL110179

SCHEMBL110179

CCCC(CC(=O)O)(N=C=O)N=C=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
ADRA1A P35348 1/20 0.33
FFAR1 O14842 1/20 0.33
CPT2 P23786 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
FFAR3 O14843 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31

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
SCHEMBL27185995 0.80
SCHEMBL374810 0.76
SCHEMBL31498882 0.72 FDPS (0.30)
SCHEMBL10336346 0.71 ALDH1A1 (0.31)
SCHEMBL11443213 0.70 HMGCR (0.44) HMGCRCHRM1TBXA2RADRA1AFFAR1
SCHEMBL17822676 0.69 ALDH1A1 (0.34)
SCHEMBL2996545 0.69
SCHEMBL4787909 0.68 GRM2 (0.31)
SCHEMBL4235248 0.67 TSHR (0.44) HMGCRCHRM1TBXA2RADRA1AFFAR1
SCHEMBL4806084 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2424931-A2 CURE ACCELERATORS FOR ANAEROBIC CURABLE COMPOSITIONS Henkel Corporation (US) 2012-03-07 EP disclosed
WO-2010127053-A2 CURE ACCELERATORS FOR ANAEROBIC CURABLE COMPOSITIONS HENKEL CORPORATION (US) 2010-11-04 WO disclosed
EP-2235117-A1 PRIMERS AND A METHOD OF COATING IN WHICH THEY ARE USED BASF Coatings Japan Ltd. (JP) 2010-10-06 EP disclosed
WO-2009093097-A1 PRIMERS AND A METHOD OF COATING IN WHICH THEY ARE USED BASF COATINGS JAPAN LTD. (DE) 2009-07-30 WO disclosed
EP-2066713-A2 NOVEL ADDUCTS AND CURABLE COMPOSITIONS USING SAME Henkel Loctite (Ireland) Limited (IE) 2009-06-10 EP disclosed
EP-1954759-A1 CURABLE COMPOSITIONS Henkel Corporation (US) 2008-08-13 EP disclosed
WO-2008038257-A2 NOVEL ADDUCTS AND CURABLE COMPOSITIONS USING SAME LOCTITE (R & D) LIMITED (IE) 2008-04-03 WO disclosed
EP-1836343-A1 A PROCEDURE TO MAKE LEATHER-LIKE SHEET ALCANTARA S.p.A. (IT) 2007-09-26 EP disclosed
WO-2007064801-A1 CURABLE COMPOSITIONS HENKEL CORPORATION (US) 2007-06-07 WO disclosed
WO-2006067583-A1 A PROCEDURE TO MAKE LEATHER-LIKE SHEET ALCANTARA S.P.A. (IT) 2006-06-29 WO disclosed
WO-2005056705-A1 WATER-DISPERSED SLURRY COATING SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2005-06-23 WO disclosed