SCHEMBL1275352

SCHEMBL1275352

CCCOC(C#N)=C(CCC)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.35
LMNA P02545 1/20 0.33
FFAR3 O14843 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
PPM1B O75688 1/20 0.32
PTPN1 P18031 1/20 0.32
PPP1CC P36873 1/20 0.32
ALDH1A1 P00352 3/20 0.32
TSHR P16473 1/20 0.32
CYP2C9 P11712 1/20 0.31
THRB P10828 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
PGGT1B P53609 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
SCHEMBL1275103 0.90 ALDH1A1 (0.41) HCAR2LMNAALDH1A1TSHRCYP2C9
SCHEMBL1275387 0.87 HCAR2 (0.36) HCAR2LMNAPPM1BPTPN1PPP1CC
SCHEMBL1274503 0.87 ALDH1A1 (0.40) HCAR2LMNAFFAR3HDAC3HDAC1
SCHEMBL1274741 0.83 ALDH1A1 (0.41) HCAR2LMNAALDH1A1TSHRCYP2C9
SCHEMBL1275318 0.81 HDAC3 (0.34) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL1275093 0.78 HCAR2 (0.37) HCAR2LMNAPPM1BPTPN1PPP1CC
SCHEMBL16246774 0.78 ALDH1A1 (0.33) ALDH1A1TSHRCYP2C9THRBFNTA
SCHEMBL1275024 0.77 ALDH1A1 (0.42) HCAR2LMNAALDH1A1TSHRCYP2C9
SCHEMBL16247070 0.73 FNTA (0.38) HCAR2ALDH1A1TSHRCYP2C9THRB
SCHEMBL7165551 0.72 THRB (0.33) TSHRTHRBFNTAFNTBPGGT1B

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-1360257-B1 CYANOACRYLATE COMPOSITIONS CURABLE TO FLEXIBLE POLYMERIC MATERIALS LOCTITE R & D LTD (IE) 2007-07-25 EP claimed
EP-1951831-B1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER HENKEL AG & CO KGAA (DE) 2011-02-23 EP disclosed
EP-1951831-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER Henkel AG & Co. KGaA (DE) 2008-08-06 EP disclosed
EP-1945702-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER Henkel AG & Co. KGaA (DE) 2008-07-23 EP disclosed
WO-2007054113-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER HENKEL AG & CO. KGAA (DE) 2007-05-18 WO disclosed
WO-2007054112-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER HENKEL AG & CO. KGAA (DE) 2007-05-18 WO disclosed