SCHEMBL134789

SCHEMBL134789

CCC=C(C)C(=O)OCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 1/20 0.50
CYP2D6 P10635 2/20 0.46
CYP2C19 P33261 2/20 0.46
ALDH1A1 P00352 5/20 0.46
LMNA P02545 3/20 0.46
HSD17B10 Q99714 1/20 0.46
NPSR1 Q6W5P4 3/20 0.45
TRPA1 O75762 1/20 0.41
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
S1PR4 O95977 1/20 0.39
S1PR1 P21453 1/20 0.39
MAPK1 P28482 1/20 0.39
TSHR P16473 1/20 0.39
ALOX15 P16050 1/20 0.39
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39

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
SCHEMBL1618911 1.00 GLO1 (0.50) GLO1CYP2D6CYP2C19ALDH1A1LMNA
Water SCHEMBL7175634 0.98 GLO1 (0.48) GLO1CYP2D6CYP2C19ALDH1A1LMNA
Ethylamine SCHEMBL28000277 0.94 GLO1 (0.45) GLO1CYP2D6CYP2C19ALDH1A1LMNA
Trimethylammonium SCHEMBL16429829 0.94 GLO1 (0.45) GLO1CYP2D6CYP2C19ALDH1A1LMNA
Dimethylamine SCHEMBL447225 0.94 GLO1 (0.45) GLO1CYP2D6CYP2C19ALDH1A1LMNA
Trimethylammonium SCHEMBL17712424 0.94 GLO1 (0.45) GLO1CYP2D6CYP2C19ALDH1A1LMNA
Acrylic Acid SCHEMBL28082177 0.90 CYP2D6 (0.44) GLO1CYP2D6CYP2C19ALDH1A1LMNA
Sulfuric Acid SCHEMBL3054230 0.87 GLO1 (0.40) GLO1CYP2D6CYP2C19ALDH1A1LMNA
SCHEMBL12984317 0.86 THRB (0.42) GLO1CYP2D6CYP2C19ALDH1A1LMNA
SCHEMBL16098677 0.84 CYP2D6 (0.35) GLO1CYP2D6CYP2C19ALDH1A1LMNA

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 212 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119214288-A Fruit-flavored essence and preparation method thereof 广州昆特臣香精香料科技有限公司 2024-12-31 CN claimed
CN-116694293-A UV glue, perovskite quantum dot glue solution and perovskite quantum dot packaging structure 张家港钛光新材料科技有限公司 2023-09-05 CN claimed
CN-116426206-A Skin-feel coating with flame-retardant function, and preparation method and application thereof 湖北航天化学新材料科技有限公司 2023-07-14 CN claimed
US-20220389251-A1 PHOTOPOLYMERIZABLE COMPOSITION, OPTICAL MEMBER AND DISPLAY DEVICE FORMED THEREFROM DONGJIN SEMICHEM CO., LTD. (KR) 2022-12-08 US claimed
CN-111548726-B MOP flame retardant, flame-retardant UV moisture dual-curing three-proofing paint and preparation method and application thereof 广东普赛达密封粘胶有限公司 2022-03-18 CN claimed
WO-2021129409-A1 METHOD FOR RAPIDLY REPAIRING ROAD SURFACE 山西中涂交通科技股份有限公司 2021-07-01 WO claimed
CN-111690274-A High-temperature-resistant organic-inorganic hybrid emulsion and preparation method thereof 锦州天壹新材科技有限公司 2020-09-22 CN claimed
CN-111548726-A MOP flame retardant, flame-retardant UV moisture dual-curing three-proofing paint and preparation method and application thereof 广东普赛达密封粘胶有限公司 2020-08-18 CN claimed
CN-110981732-A Refining device and method for by-product dimethyl carbonate in process of preparing ethylene glycol from coal 凯瑞环保科技股份有限公司 2020-04-10 CN claimed
US-9351908-B2 Orthodontic composition with polymeric fillers 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-05-31 US claimed
WO-2011149836-A1 TEXTILE-TEMPLATED ELECTROSPUN ANISOTROPIC SCAFFOLDS FOR TISSUE ENGINEERING AND REGENERATIVE MEDICINE DREXEL UNIVERSITY (US) 2011-12-01 WO claimed
US-20110229838-A1 ORTHODONTIC COMPOSITION WITH POLYMERIC FILLERS 3M INNOVATIVE PROPERTIES COMPANY 2011-09-22 US claimed
JP-2011509921-A 2011-03-31 JP claimed
EP-2203144-A2 ORTHODONTIC COMPOSITION WITH POLYMERIC FILLERS 3M Innovative Properties Company (US) 2010-07-07 EP claimed
WO-2009045752-A2 ORTHODONTIC COMPOSITION WITH POLYMERIC FILLERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-04-09 WO claimed
US-20020058724-A1 Contact lens of high water content and high water balance BENZ RESEARCH AND DEVELOPMENT CORPORATION 2002-05-16 US claimed
US-20020019455-A1 Contact lens of high water content and high water balance BENZ RESEARCH AND DEVELOPMENT CORPORATION 2002-02-14 US claimed
EP-1084427-A1 CONTACT LENS OF HIGH WATER CONTENT AND HIGH WATER BALANCE Benz Research and Development Corporation (US) 2001-03-21 EP claimed
WO-1999057582-A1 CONTACT LENS OF HIGH WATER CONTENT AND HIGH WATER BALANCE BENZ RESEARCH AND DEVELOPMENT CORPORATION (US) 1999-11-11 WO claimed
US-4233409-A DUCTILITY AND TOUGNESS AT LOW TEMPERATURES MONSANTO COMPANY (US) 1980-11-11 US claimed