Terephthalic Acid

Terephthalic Acid

SCHEMBL2371036

O=C(O)c1ccc(C(=O)O)cc1.O=C(O)c1ccccc1-c1ccccc1C(=O)O

nearest known ligand 0.59

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
TSHR P16473 3/20 0.59
ALDH1A1 P00352 3/20 0.59
DAO P14920 1/20 0.59
NAPRT Q6XQN6 1/20 0.59
ALOX15 P16050 1/20 0.59
CYP2C9 P11712 2/20 0.59
CYP2C8 P10632 1/20 0.59
TP53 P04637 1/20 0.57
CYP3A4 P08684 1/20 0.57
ALOX12 P18054 1/20 0.57
SRD5A2 P31213 2/20 0.56
CES2 O00748 1/20 0.56
CES1 P23141 1/20 0.56
MYC P01106 1/20 0.53
GAA P10253 1/20 0.53
AKR1C3 P42330 1/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA9 Q16790 1/20 0.52

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
SCHEMBL30028907 0.90 ALDH1A1 (0.72) ALDH1A1NAPRTALOX15CYP2C9CYP3A4
SCHEMBL36145 0.90 ALDH1A1 (0.72) ALDH1A1NAPRTALOX15CYP2C9CYP3A4
Terephthalic Acid SCHEMBL9017394 0.90 CYP2C9 (0.59) TSHRDAONAPRTCYP2C9CYP2C8
SCHEMBL70136 0.89 CDC25B (0.55) TSHRALDH1A1DAONAPRTALOX15
SCHEMBL2830888 0.87 ALDH1A1 (0.68) ALDH1A1NAPRTALOX15CYP2C9CYP3A4
Hydrochloric Acid SCHEMBL10888462 0.87 ALDH1A1 (0.68) ALDH1A1NAPRTALOX15CYP2C9CYP3A4
SCHEMBL28408894 0.87 ALDH1A1 (0.68) ALDH1A1NAPRTALOX15CYP2C9CYP3A4
Hydrochloric Acid SCHEMBL1681943 0.87 ALDH1A1 (0.68) ALDH1A1NAPRTALOX15CYP2C9CYP3A4
Hydrochloric Acid SCHEMBL7579852 0.87 ALDH1A1 (0.68) ALDH1A1NAPRTALOX15CYP2C9CYP3A4
SCHEMBL30620175 0.87 ALDH1A1 (0.68) ALDH1A1NAPRTALOX15CYP2C9CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011112548-A2 IMPROVING ADHESION IN ECTFE/POLYESTER CO-EXTRUDED STRUCTURES USING TIE LAYERS SAINT-GOBAIN PERFORMANCE PLASTICS CORPORATION (US) 2011-09-15 WO claimed
EP-4298148-A1 SYNTHESIS OF FUNCTIONAL POLYURETHANES AND POLYESTERS FROM BIOMASS-DERIVED MONOMERS Wisconsin Alumni Research Foundation (US) 2024-01-03 EP disclosed
US-11692058-B2 Synthesis of functional polyurethanes and polyesters from biomass-derived monomers WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2023-07-04 US disclosed
US-20200262971-A1 TEREPHTHALATE-CO-4,4-BIBENZOATE POLYESTERS EXXONMOBIL CHEMICAL PATENTS INC (US) 2020-08-20 US disclosed
EP-3394130-A1 TEREPHTHALATE-CO-BIBENZOATE POLYESTERS ExxonMobil Chemical Patents Inc. (US) 2018-10-31 EP disclosed
WO-2017112031-A1 TEREPHTHALATE-CO-BIBENZOATE POLYESTERS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-06-29 WO disclosed
WO-2011112548-A2 IMPROVING ADHESION IN ECTFE/POLYESTER CO-EXTRUDED STRUCTURES USING TIE LAYERS SAINT-GOBAIN PERFORMANCE PLASTICS CORPORATION (US) 2011-09-15 WO disclosed
EP-2231399-A2 CO-EXTRUDED FLUOROPOLYMER MULTILAYER LAMINATES Saint-Gobain Performance Plastics Corporation (US) 2010-09-29 EP disclosed
WO-2009085182-A2 CO-EXTRUDED FLUOROPOLYMER MULTILAYER LAMINATES SAINT-GOBAIN PERFORMANCE PLASTICS CORPORATION (US) 2009-07-09 WO disclosed