SCHEMBL2484515

SCHEMBL2484515

CCC=C(CCO)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 4/20 0.48
GRIK2 Q13002 3/20 0.48
ABAT P80404 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
EP300 Q09472 1/20 0.30
FFAR1 O14842 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
CYP19A1 P11511 1/20 0.30
RXRA P19793 1/20 0.30
PPARG P37231 1/20 0.30
OXER1 Q8TDS5 1/20 0.30
KDM4E B2RXH2 1/20 0.30
TSHR P16473 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
SCHEMBL3503144 1.00 GRIK1 (0.48) GRIK1GRIK2ABATFFAR3HDAC3
SCHEMBL11480862 0.86 GRIK1 (0.46) GRIK1GRIK2ABATEP300FFAR1
SCHEMBL691600 0.83 GRIK1 (0.50) GRIK1GRIK2ABATFFAR3HDAC3
SCHEMBL1003142 0.83 GRIK1 (0.50) GRIK1GRIK2ABATFFAR3HDAC3
SCHEMBL9493661 0.83 GRIK1 (0.50) GRIK1GRIK2ABATFFAR3HDAC3
Hydrochloric Acid SCHEMBL9624870 0.81 GRIK1 (0.48) GRIK1GRIK2ABATFFAR3HDAC3
Ethylene Glycol SCHEMBL28971004 0.81 GRIK1 (0.48) GRIK1GRIK2ABATFFAR3EP300
SCHEMBL10408349 0.81 GRIK1 (0.48) GRIK1GRIK2ABATFFAR3HDAC3
SCHEMBL10408352 0.81 GRIK1 (0.48) GRIK1GRIK2ABATFFAR3HDAC3
SCHEMBL10412636 0.81 GRIK1 (0.48) GRIK1GRIK2ABATFFAR3HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2376053-B1 POROUS POLYMER COATING FOR TOOTH WHITENING JOHNSON & JOHNSON CONSUMER INC (US) 2019-09-25 EP disclosed
CN-109970997-A A kind of preparation method of hydroxyethyl acrylate hydrogel 安徽理工大学 2019-07-05 CN disclosed
US-9296846-B2 Porous polymer coating for tooth whitening THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2016-03-29 US disclosed
US-8173159-B2 Solid permeable shell of a polymer resin having surface modifying compounds that can react with isocyanates SYNGENTA LIMITED (GB) 2012-05-08 US disclosed
EP-2376053-A1 POROUS POLYMER COATING FOR TOOTH WHITENING McNeil-PPC, Inc. (US) 2011-10-19 EP disclosed
WO-2010080501-A1 POROUS POLYMER COATING FOR TOOTH WHITENING MCNEIL-PPC, INC. (US) 2010-07-15 WO disclosed
US-20100158960-A1 POROUS POLYMER COATING FOR TOOTH WHITENING KENVUE BRANDS LLC 2010-06-24 US disclosed
US-7271200-B2 Emulsions SYNGENTA LIMITED (GB) 2007-09-18 US disclosed
EP-1294478-B1 NOVEL EMULSIONS SYNGENTA LTD (GB) 2005-12-28 EP disclosed
EP-1292386-B1 NOVEL MICROCAPSULES SYNGENTA LTD (GB) 2005-11-16 EP disclosed
US-20040176479-A1 Novel emulsions SCHER HERBERT BENSON (US) 2004-09-09 US disclosed
US-6710092-B2 DISPERSED PHASE DROPLET HAVING SURFACTANT LAYER AT INTERFACE WITH CONTINUOUS PHASE WHEREIN SURFACTANT LAYER IS FORMED BY REACTION OF WALL-FORMING MOIETIES OF MICROCAPSULE WALL FORMING MATERIAL WITH INTERFACE MODIFYING COMPOUND SYNGENTA LIMITED (GB) 2004-03-23 US disclosed
EP-1294478-A2 NOVEL EMULSIONS Syngenta Limited (GB) 2003-03-26 EP disclosed
EP-1292386-A2 NOVEL MICROCAPSULES Syngenta Limited (GB) 2003-03-19 EP disclosed
US-20020136773-A1 Novel microcapsules SYNGENTA LIMITED (GB) 2002-09-26 US disclosed
US-20020040065-A1 Novel emulsions SYNGENTA LIMITED (GB) 2002-04-04 US disclosed
WO-2001094002-A2 NOVEL EMULSIONS SYNGENTA LIMITED (GB) 2001-12-13 WO disclosed
WO-2001094001-A2 NOVEL MICROCAPSULES SYNGENTA LIMITED (GB) 2001-12-13 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100158960-A1 POROUS POLYMER COATING FOR TOOTH WHITENING MMP20, COL14A1, POLR1C GRIK1 1492/4885GRIK2 1524/4885ABAT 4564/4885
US-20020136773-A1 Novel microcapsules BPHL, CD68, RCC1 GRIK1 1577/4885GRIK2 1043/4885ABAT 2913/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.