SCHEMBL1226201

SCHEMBL1226201

CC=CC(N)CC(=O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL1895562 1.00
SCHEMBL1226199 1.00
SCHEMBL7423155 0.77 GRIK1 (0.39)
SCHEMBL1896363 0.76 GABRP (0.50)
SCHEMBL1225632 0.76 GABRP (0.50)
SCHEMBL1225631 0.76 GABRP (0.50)
SCHEMBL16800085 0.75 SLC22A6 (0.39)
SCHEMBL14150313 0.75 SLC22A6 (0.39)
SCHEMBL14150311 0.75 SLC22A6 (0.39)
SCHEMBL19015754 0.74 CTSC (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10415063-B2 Semi-synthetic terephthalic acid via microorganisms that produce muconic acid GENOMATICA, INC. (US) 2019-09-17 US disclosed
US-20180312883-A1 SEMI-SYNTHETIC TEREPHTHALIC ACID VIA MICROORGANISMS THAT PRODUCE MUCONIC ACID GENOMATICA, INC. 2018-11-01 US disclosed
US-10041093-B2 Semi-synthetic terephthalic acid via microorganisms that produce muconic acid GENOMATICA, INC. (US) 2018-08-07 US disclosed
EP-3190174-A1 SEMI-SYNTHETIC TEREPHTHALIC ACID VIA MICROORGANISMS THAT PRODUCE MUCONIC ACID Genomatica, Inc. (US) 2017-07-12 EP disclosed
US-20170096689-A1 SEMI-SYNTHETIC TEREPHTHALIC ACID VIA MICROORGANISMS THAT PRODUCE MUCONIC ACID GENOMATICA, INC. 2017-04-06 US disclosed
EP-2462221-B1 SEMI-SYNTHETIC TEREPHTHALIC ACID VIA MICROORGANISMS THAT PRODUCE MUCONIC ACID GENOMATICA INC (US) 2017-02-22 EP disclosed
US-9562241-B2 Semi-synthetic terephthalic acid via microorganisms that produce muconic acid GENOMATICA, INC. (US) 2017-02-07 US disclosed
US-20140302573-A1 SEMI-SYNTHETIC TEREPHTHALIC ACID VIA MICROORGANISMS THAT PRODUCE MUCONIC ACID GENOMATICA INC (US) 2014-10-09 US disclosed
EP-2462221-A1 SEMI-SYNTHETIC TEREPHTHALIC ACID VIA MICROORGANISMS THAT PRODUCE MUCONIC ACID Genomatica, Inc. (US) 2012-06-13 EP disclosed
US-20110124911-A1 SEMI-SYNTHETIC TEREPHTHALIC ACID VIA MICROORGANISMS THAT PRODUCE MUCONIC ACID GENOMATICA, INC. 2011-05-26 US disclosed
WO-2011017560-A1 SEMI-SYNTHETIC TEREPHTHALIC ACID VIA MICROORGANISMS THAT PRODUCE MUCONIC ACID GENOMATICA, INC. (US) 2011-02-10 WO disclosed
EP-1102757-A1 SUBSTITUTED OXAZOLE AND THIAZOLE DERIVATIVES AS HPPAR GAMMA AND HPPAR ALPHA ACTIVATORS GLAXO GROUP LIMITED (GB) 2001-05-30 EP disclosed
WO-2000008002-A1 SUBSTITUTED OXAZOLES AND THIAZOLES DERIVATIVES AS hPPAR GAMMA AND hPPAR ALPHA ACTIVATORS GLAXO GROUP LIMITED (GB) 2000-02-17 WO disclosed