Terephthalic Acid

Terephthalic Acid

SCHEMBL27990724

O=C(O)c1ccc(C(=O)O)cc1.c1c[nH]nn1

nearest known ligand 0.50

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 0.50
▸ TP53 P04637 1/20 0.50
▸ NAPRT Q6XQN6 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ SRD5A2 P31213 3/20 0.44
▸ CA1 P00915 3/20 0.43
▸ CA2 P00918 3/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA3 P07451 1/20 0.43
▸ TYR P14679 1/20 0.43
▸ DRD1 P21728 1/20 0.43
▸ CA4 P22748 1/20 0.43
▸ CA6 P23280 1/20 0.43
▸ CA5A P35218 1/20 0.43
▸ CA7 P43166 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ CA14 Q9ULX7 1/20 0.43
▸ CA5B Q9Y2D0 1/20 0.43
▸ HCAR2 Q8TDS4 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
Terephthalic Acid SCHEMBL28013542 0.98 TSHR (0.48) TSHRTP53NAPRTALDH1A1KDM4E
Terephthalic Acid SCHEMBL28044877 0.98 TSHR (0.48) TSHRTP53NAPRTALDH1A1KDM4E
Terephthalic Acid SCHEMBL28005997 0.98 TSHR (0.48) TSHRTP53NAPRTALDH1A1KDM4E
Terephthalic Acid SCHEMBL28065968 0.98 TSHR (0.48) TSHRTP53NAPRTALDH1A1KDM4E
Paraben SCHEMBL5369593 0.93 CA2 (0.57) TSHRTP53NAPRTALDH1A1KDM4E
Terephthalic Acid SCHEMBL28600607 0.93 TSHR (0.43) TSHRTP53NAPRTALDH1A1KDM4E
Benzoic Acid SCHEMBL17495601 0.92 NAPRT (0.54) TSHRTP53NAPRTALDH1A1KDM4E
Terephthalic Acid SCHEMBL27990425 0.89 TSHR (0.42) TSHRTP53NAPRTALDH1A1KDM4E
SCHEMBL28054671 0.88 KDM4E (0.49) TSHRALDH1A1KDM4ECA1CA2
Terephthalic Acid SCHEMBL28067237 0.88 TSHR (0.45) TSHRTP53NAPRTALDH1A1KDM4E

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104610380-B Triazole terephthalic acid (TPA) cobalt complex of phenyl triiodide amine three with potential fluorescent material and preparation method thereof 天津师范大学 2017-08-11 — — CN claimed
CN-106187925-A The double triazole terephthalic acid compounds monocrystalline of 4H thioether and application 天津师范大学 2016-12-07 — — CN claimed
CN-104610324-B There are phenyl triiodide amine three triazole terephthalic acid (TPA) cadmium complexes of potential fluorescent material and preparation method thereof TIANJIN NORMAL UNIVERSITY (CN) 2016-05-18 — — CN claimed
CN-105566359-A 1,4-dimethyl-2,5-dimethylene bis(triazole) zinc terephthalate complex monocrystal and applications thereof UNIV TIANJIN 2016-05-11 — — CN claimed
CN-105524085-A 1, 4-dimethyl-2, 5-dimethylene bistriazole terephthalic acid three-dimensional zinc complex single crystal and application thereof UNIV TIANJIN 2016-04-27 — — CN claimed
CN-105524088-A Anthracycline bistriazole terephthalic acid inclusion diethyl formamide zinc complex single crystal and application thereof UNIV TIANJIN 2016-04-27 — — CN claimed
CN-105524086-A Potential fluorescent material tetraphenyl ethylene tetra-triazole terephthalic acid zinc complex and preparation method thereof UNIV TIANJIN 2016-04-27 — — CN claimed
CN-105418523-A 1,4-dimethyl-2,5-dimethylene bis(triazole)terephthalic acid single crystal and application UNIV TIANJIN 2016-03-23 — — CN claimed
CN-105294743-A 4H sulfide double triazole terephthalic acid zinc complex single crystal and preparation method as well as application thereof UNIV TIANJIN NORMAL 2016-02-03 — — CN claimed
CN-104610299-A Zinc naphthalene bistriazole terephthalic acid complex used as potential fluorescent material and preparation method thereof UNIV TIANJIN NORMAL 2015-05-13 — — CN claimed
CN-104610303-A Zinc triiodo phenylamine tri-triazole terephthalic acid complex used as potential fluorescent material and preparation method thereof UNIV TIANJIN NORMAL 2015-05-13 — — CN claimed
CN-104610302-A Antharcycline bis-triazole terephthalic acid zinc complex with potential fluorescent material and preparation method of antharcycline bis-triazole terephthalic acid zinc complex UNIV TIANJIN NORMAL 2015-05-13 — — CN claimed
CN-104610295-A Potential fluorescent material containing tetraphenylethylene tetra-triazole zinc terephthalate complex and preparation method thereof UNIV TIANJIN NORMAL 2015-05-13 — — CN claimed
CN-104610380-B Triazole terephthalic acid (TPA) cobalt complex of phenyl triiodide amine three with potential fluorescent material and preparation method thereof 天津师范大学 2017-08-11 — — CN disclosed
CN-104610380-B Triazole terephthalic acid (TPA) cobalt complex of phenyl triiodide amine three with potential fluorescent material and preparation method thereof 天津师范大学 2017-08-11 — — CN disclosed
CN-104610380-B Triazole terephthalic acid (TPA) cobalt complex of phenyl triiodide amine three with potential fluorescent material and preparation method thereof 天津师范大学 2017-08-11 — — CN disclosed
CN-104610299-A Zinc naphthalene bistriazole terephthalic acid complex used as potential fluorescent material and preparation method thereof UNIV TIANJIN NORMAL 2015-05-13 — — CN disclosed
CN-104610303-A Zinc triiodo phenylamine tri-triazole terephthalic acid complex used as potential fluorescent material and preparation method thereof UNIV TIANJIN NORMAL 2015-05-13 — — CN disclosed
CN-104610302-A Antharcycline bis-triazole terephthalic acid zinc complex with potential fluorescent material and preparation method of antharcycline bis-triazole terephthalic acid zinc complex UNIV TIANJIN NORMAL 2015-05-13 — — CN disclosed
CN-104610295-A Potential fluorescent material containing tetraphenylethylene tetra-triazole zinc terephthalate complex and preparation method thereof UNIV TIANJIN NORMAL 2015-05-13 — — CN disclosed
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