SCHEMBL4889828

SCHEMBL4889828

C=C(C#N)C(=O)OCOCCC

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.61
ALDH1A1 P00352 1/20 0.61
THRB P10828 1/20 0.34
CYP2C9 P11712 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL4892551 0.90 TSHR (0.58) TSHRALDH1A1THRB
SCHEMBL605391 0.86 TSHR (0.61) TSHRALDH1A1THRBCYP2C9KDM4E
SCHEMBL828235 0.85 ALDH1A1 (0.71) TSHRALDH1A1THRBCYP2C9KDM4E
SCHEMBL167355 0.85 TSHR (0.70) TSHRALDH1A1THRBCYP2C9KDM4E
SCHEMBL4892572 0.83 TSHR (0.58) TSHRALDH1A1THRB
Propionic Acid SCHEMBL27993815 0.79 TSHR (0.61) TSHRALDH1A1THRBCYP2C9KDM4E
Enbucrilate SCHEMBL24796 0.78 TSHR (0.66) TSHRALDH1A1THRB
SCHEMBL1902057 0.77 THRB (0.57) TSHRALDH1A1THRB
SCHEMBL10405585 0.77 ALDH1A1 (0.64) TSHRALDH1A1CYP2C9KDM4EMEN1
SCHEMBL27511405 0.77 TSHR (0.50) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1239653-C Cyanoacrylate compositions, reaction products, methods of preparation and uses thereof LOCTITE R & D LTD (IE) 2006-02-01 CN claimed
CN-1487983-A Cyanoacrylate compositions curable to flexible polymeric materials ���̩��(R&D)���޹�˾ 2004-04-07 CN claimed
CN-113874459-A Flexible photocurable cyanoacrylate compositions 汉高知识产权控股有限责任公司 2021-12-31 CN disclosed
US-10240047-B2 Cyanoacrylate composition and coating method using the cyanoacrylate composition THREEBOND CO., LTD. (JP) 2019-03-26 US disclosed
US-20180340130-A1 LUBRICANT COMPOSITION NOK KLUBER., LTD (JP) 2018-11-29 US disclosed
US-20170260398-A1 CYANOACRYLATE COMPOSITION AND COATING METHOD USING THE CYANOACRYLATE COMPOSITION THREEBOND CO., LTD. (JP) 2017-09-14 US disclosed
CN-102264852-A Adhesive composition 2011-11-30 CN disclosed
US-20080293872-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER HENKEL AG & CO. KGAA (DE) 2008-11-27 US disclosed
US-20080287574-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER HENKEL AG & CO. KGAA (DE) 2008-11-20 US disclosed
CN-101305064-A Binding agent, sealant and paint containing glass particle as filling material HENKEL AG & CO KGAA (DE) 2008-11-12 CN disclosed
CN-101305040-A Binding agent, sealant and paint containing glass particle as filling material HENKEL AG & CO KGAA (DE) 2008-11-12 CN disclosed
CN-1239653-C Cyanoacrylate compositions, reaction products, methods of preparation and uses thereof LOCTITE R & D LTD (IE) 2006-02-01 CN disclosed
CN-1487983-A Cyanoacrylate compositions curable to flexible polymeric materials ���̩��(R&D)���޹�˾ 2004-04-07 CN disclosed