SCHEMBL8633185

SCHEMBL8633185

C=CCOC(=O)C(O)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
CACNA1B Q00975 1/20 0.41
APBA1 Q02410 1/20 0.41
CYP3A4 P08684 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 2/20 0.37
ALDH1A1 P00352 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PKM P14618 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
GRIK1 P39086 2/20 0.31
GRIK2 Q13002 2/20 0.31
CASP1 P29466 1/20 0.31
SNCA P37840 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL7036156 0.88 CYP3A4 (0.43) MAPTCACNA1BAPBA1CYP3A4TDP1
SCHEMBL167950 0.80 TSHR (0.43) MAPTCACNA1BAPBA1CYP3A4TDP1
SCHEMBL6064410 0.80 MAPT (0.44) MAPTCACNA1BAPBA1CYP3A4TDP1
SCHEMBL5227209 0.80 TDP1 (0.41) MAPTCACNA1BAPBA1CYP3A4TDP1
SCHEMBL18658527 0.78 CYP3A4 (0.37) MAPTCACNA1BAPBA1CYP3A4TDP1
SCHEMBL2363000 0.78 TSHR (0.42) MAPTCACNA1BAPBA1CYP3A4TDP1
Lactic Acid SCHEMBL27586439 0.78 TP53 (0.46) MAPTCACNA1BAPBA1CYP3A4TDP1
SCHEMBL167949 0.78 CYP3A4 (0.43) MAPTCACNA1BAPBA1CYP3A4TDP1
SCHEMBL4195585 0.78
SCHEMBL27669919 0.77 PDE4A (0.42) MAPTCACNA1BAPBA1CYP3A4TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3145019-A1 NON-AQUEOUS ELECTROLYTE, POWER STORAGE DEVICE USING SAME, AND LITHIUM SALT USED FOR SAME UBE Industries, Ltd. (JP) 2017-03-22 EP disclosed
US-5773465-A Tartronic acids, their acetalic ethers and o-esters DOMPE FARMACEUTICI S.P.A. (IT) 1998-06-30 US disclosed
US-5656656-A Tartronic acids, their acetalic ethers and O-esters DOMPE FARMACEUTICI S.P.A. (IT) 1997-08-12 US disclosed
EP-0667850-B1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS DOMPE FARMACEUTICI SPA (IT) 1997-05-28 EP disclosed
EP-0667850-A1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS. DOMPE FARMACEUTICI SPA (IT) 1995-08-23 EP disclosed
CN-1091633-A Use aryl-, heteroaryl-and alkyltartronic acids as therapeutic agent DOMPE FRAMACEUTICI S P A (IT) 1994-09-07 CN disclosed
WO-1994010127-A1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS DOMPE' FARMACEUTICI S.P.A. (IT) 1994-05-11 WO disclosed
EP-0354894-B1 MANUFACTURE OF ALKYL GLYOXYLATES WITH FERRIC PHOSPHATE CATALYST MONSANTO COMPANY (US) 1993-03-31 EP disclosed
US-5118652-A Oxidation catalyst calcined on alumina or AL2O3/SIO2 support MONSANTO COMPANY (US) 1992-06-02 US disclosed
EP-0354894-A1 Manufacture of alkyl glyoxylates with ferric phosphate catalyst MONSANTO COMPANY (US) 1990-02-14 EP disclosed
US-4900864-A Manufacture of alkyl glyoxylates with ferric phosphate catalyst CITICORP USA, INC., 1990-02-13 US disclosed
US-4504673-A Preparation of tartronic esters BAYER AKTIENGESELLSCHAFT (DE) 1985-03-12 US disclosed
US-4501916-A REACTION OF LOWER ALCOHOL WITH OPTIONALLY HALOGEN-SUBSTITUTED 1-HYDROXY-1,1-DICYANO-ALKANE MONTEDISON S.P.A. (IT) 1985-02-26 US disclosed
EP-0056264-B1 PROCESS FOR PREPARING ALKYL ESTERS OF C-ALKYL-TARTRONIC OR C-HALOGENALKYL-TARTRONIC ACIDS Montedison S.p.A. (IT) 1984-07-25 EP disclosed
EP-0056264-A1 Process for preparing alkyl esters of C-alkyl-tartronic or C-halogenalkyl-tartronic acids Montedison S.p.A. (IT) 1982-07-21 EP disclosed
US-4143125-A CALCULUS-INHIBITING COMPOSITIONS AND METHOD MONSANTO COMPANY (US) 1979-03-06 US disclosed