Terephthalic Acid

Terephthalic Acid

SCHEMBL1697283

COC(=O)C1=CCC1.O=C(O)c1ccc(C(=O)O)cc1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1

The experimentally established mechanism targets of Terephthalic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.47
CA2 P00918 3/20 0.47
TSHR P16473 2/20 0.44
TP53 P04637 1/20 0.44
PTPN1 P18031 1/20 0.44
CHRM3 P20309 2/20 0.43
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
CA12 O43570 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
KDM4E B2RXH2 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MAPK1 P28482 1/20 0.42
LMNA P02545 1/20 0.42
CHRM2 P08172 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM5 P08912 1/20 0.42
THRB P10828 1/20 0.42

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
SCHEMBL9182227 0.86 PTPN1 (0.47) CA1CA2TSHRPTPN1CHRM3
SCHEMBL43992 0.86
Acetic Acid SCHEMBL5156006 0.84 PTPN1 (0.49) CA1CA2TSHRPTPN1CHRM3
Acrylic Acid SCHEMBL305444 0.78 PTPN1 (0.48) TSHRPTPN1CHRM3ALDH1A1KDM4E
Terephthalic Acid SCHEMBL18394717 0.78 TSHR (0.70) CA1CA2TSHRTP53ALDH1A1
Terephthalic Acid SCHEMBL4349174 0.78 TSHR (0.70) CA1CA2TSHRTP53ALDH1A1
SCHEMBL27555709 0.78 TSHR (0.70) CA1CA2TSHRTP53ALDH1A1
SCHEMBL63466 0.78 TSHR (0.70) CA1CA2TSHRTP53ALDH1A1
Terephthalic Acid SCHEMBL8811649 0.78 TSHR (0.70) CA1CA2TSHRTP53ALDH1A1
SCHEMBL11668494 0.76 TSHR (0.67) CA1CA2TSHRTP53ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2486600-A2 METHOD FOR MANUFACTURING MULTILAYER FILMS AND SOLAR PANEL BACKSHEETS FORMED THEREOF E. I. du Pont de Nemours and Company (US) 2012-08-15 EP disclosed
US-20110247681-A1 METHOD FOR MANUFACTURING MULTILAYER FILMS AND SOLAR PANEL BACKSHEETS FORMED THEREOF E. I. DU PONT DE NEMOURS AND COMPANY (DE) 2011-10-13 US disclosed
WO-2011044417-A2 METHOD FOR MANUFACTURING MULTILAYER FILMS AND SOLAR PANEL BACKSHEETS FORMED THEREOF E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-04-14 WO disclosed