SCHEMBL3389714

SCHEMBL3389714

CCOC(=O)CC(C)C(C(=O)OCC)C(=O)OCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.46
GAA P10253 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
ALDH1A1 P00352 8/20 0.43
ALOX15 P16050 3/20 0.43
CYP3A4 P08684 2/20 0.43
TSHR P16473 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
TRPA1 O75762 1/20 0.43
HSD17B10 Q99714 2/20 0.42
CHRM1 P11229 1/20 0.42
ADORA1 P30542 1/20 0.42
CYP2D6 P10635 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP1A2 P05177 1/20 0.38
LMNA P02545 2/20 0.37
KMT2A Q03164 3/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL3394619 1.00 MGAM (0.46) MGAMGAASIMGAM2ALDH1A1
SCHEMBL3392959 0.88 MGAM (0.40) MGAMGAASIMGAM2ALDH1A1
SCHEMBL3395509 0.88 MGAM (0.40) MGAMGAASIMGAM2ALDH1A1
SCHEMBL3397234 0.88 GAA (0.48) MGAMGAASIMGAM2ALDH1A1
SCHEMBL3394662 0.88 GAA (0.48) MGAMGAASIMGAM2ALDH1A1
SCHEMBL3396195 0.88 MGAM (0.43) MGAMGAASIMGAM2ALDH1A1
SCHEMBL3397834 0.88 MGAM (0.43) MGAMGAASIMGAM2ALDH1A1
SCHEMBL11318856 0.86 MGAM (0.55) MGAMGAASIMGAM2ALDH1A1
SCHEMBL4191467 0.84 ALDH1A1 (0.43) MGAMGAASIMGAM2ALDH1A1
SCHEMBL10841052 0.83 ALDH1A1 (0.42) MGAMGAASIMGAM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2154253-B1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYL-1,1,3-TRIALKOXYCARBONYLPROPANE SUMITOMO CHEMICAL CO (JP) 2019-04-10 EP disclosed
US-9970043-B2 Process for producing optically active 2-alkyl-1,1,3-trialkoxycarbonylpropane GENENTECH, INC. (US) 2018-05-15 US disclosed
US-20170145468-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYL-1,1,3-TRIALKOXYCARBONYLPROPANE GENENTECH, INC. (US) 2017-05-25 US disclosed
US-20150218602-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYL-1,1,3-TRIALKOXYCARBONYLPROPANE GENENTECH INC (US) 2015-08-06 US disclosed
US-8969051-B2 Process for producing optically active 2-alkyl-1,1,3-trialkoxycarbonylpropane SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-03-03 US disclosed
US-20100240107-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYL-1,1,3-TRIALKOXYCARBONYLPROPANE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-23 US disclosed
EP-2154253-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYL-1,1,3-TRIALKOXYCARBONYLPROPANE Sumitomo Chemical Company, Limited (JP) 2010-02-17 EP disclosed
US-5061730-A INHIBITORS OF DEHYDROPEPTIDASE AND RENAL DIPEPTIDASE; PREVENT UNNECESSARY HYDROLYSIS OF BETA-LACTAM RING OF CARBAPENEM ANTIB IOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-10-29 US disclosed
EP-0276947-B1 CARBOXYLIC ACID DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-09-18 EP disclosed
EP-0276947-A2 Carboxylic acid derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-08-03 EP disclosed