SCHEMBL3937564

SCHEMBL3937564

CCOC(=O)C(C)(C)N=NC(C)(C)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
CYP4F2 P78329 3/20 0.39
CYP4A11 Q02928 3/20 0.39
ALDH1A1 P00352 3/20 0.37
PKM P14618 3/20 0.37
MMP8 P22894 2/20 0.37
PIN1 Q13526 1/20 0.37
TRPA1 O75762 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
THRB P10828 1/20 0.35
ABCB11 O95342 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL11725731 1.00 MGAM (0.39) MGAMGAASIMGAM2CYP4F2
SCHEMBL530506 0.91 CYP4F2 (0.44) MGAMGAASIMGAM2CYP4F2
SCHEMBL1713464 0.91 CYP4F2 (0.44) MGAMGAASIMGAM2CYP4F2
SCHEMBL28527730 0.84 HCAR2 (0.37) ALDH1A1LMNATSHRHCAR2
SCHEMBL3142256 0.83 PKM (0.41) MGAMGAASIMGAM2CYP4F2
SCHEMBL3142260 0.83 PKM (0.41) MGAMGAASIMGAM2CYP4F2
SCHEMBL28530635 0.81 ALDH1A1 (0.44) ALDH1A1LMNACYP1A2TSHRHCAR2
SCHEMBL1705783 0.77 TSHR (0.39) PKMCYP3A4TSHR
SCHEMBL158350 0.76 ALDH1A1 (0.47) ALDH1A1CYP3A4TSHR
SCHEMBL57501 0.76 ALDH1A1 (0.47) ALDH1A1CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070265474-A1 Method for Producing 4-(Methylthio)Butane-1,2-Diol SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-11-15 US claimed
EP-1790632-A1 METHOD FOR PRODUCING 4-(METHYLTHIO)BUTANE-1,2-DIOL Sumitomo Chemical Company, Limited (JP) 2007-05-30 EP claimed
US-4723035-A Method for racemization of chrysanthemic acid or its ester SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-02-02 US claimed
CN-110885401-B Copolymer, curable resin composition containing same, and cured product thereof 株式会社大赛璐 2023-06-13 CN disclosed
CN-108250369-B Preparation method of low-odor high-weather-resistance polymer polyol 万华化学集团股份有限公司 2021-03-09 CN disclosed
US-20150366643-A1 TOOTH VENEER ELEMENT, AND METHOD FOR THE USE AND PRODUCTION THEREOF COLTÈNE/WHALEDENT AG (CH) 2015-12-24 US disclosed
US-20130143279-A1 PROCESS FOR PRODUCING METHIONINE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-06-06 US disclosed
EP-2576504-A1 PROCESS FOR PRODUCING METHIONINE Sumitomo Chemical Co., Ltd (JP) 2013-04-10 EP disclosed
WO-2011152540-A1 PROCESS FOR PRODUCING METHIONINE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-12-08 WO disclosed
US-7632664-B2 Method for producing 2-hydroxy-4-(methylthio)butyric acid SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-12-15 US disclosed
EP-1801227-B1 METHOD FOR PRODUCING 2-HYDROXY-4-(METHYLTHIO)BUTANOIC ACID SUMITOMO CHEMICAL CO (JP) 2009-04-15 EP disclosed
US-4788323-A Method for racemization of optically active chrysanthemic acid or its ester SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-11-29 US disclosed
EP-0282221-A2 Method for racemization of optically active chrysanthemic acid or its ester SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-09-14 EP disclosed
EP-0261824-A1 Method for racemization of optically active chrysanthemic acid or its ester SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-03-30 EP disclosed
US-4723035-A Method for racemization of chrysanthemic acid or its ester SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-02-02 US disclosed
EP-0235940-A1 Method for racemization of chrysanthemic acid or its ester SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-09-09 EP disclosed
US-4448945-A SOLUBLE IN ORGANIC SOLVENTS, CLEAR SOLUTIONS AND FILMS ROHM GMBH (DE) 1984-05-15 US disclosed
US-4059574-A POLYMERIZATION CATALYSTS ROHM GMBH (DT) 1977-11-22 US disclosed
US-4042558-A Filled polymerization products based on carbodiimide copolymers BAYER AKTIENGESELLSCHAFT (DT) 1977-08-16 US disclosed
US-3948866-A Polymerization with the aid of macromolecule having both a monomer soluble portion and suspension soluble portion ROHM GMBH (DT) 1976-04-06 US disclosed