Terephthalic Acid

Terephthalic Acid

SCHEMBL6067574

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

nearest known ligand 0.60

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 0.60
TP53 P04637 1/20 0.60
SRD5A2 P31213 3/20 0.52
ALDH1A1 P00352 3/20 0.50
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA12 O43570 1/20 0.50
CA3 P07451 1/20 0.50
TYR P14679 1/20 0.50
DRD1 P21728 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
CA5A P35218 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
CA5B Q9Y2D0 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.48
ALOX15 P16050 1/20 0.48
TPMT P51580 1/20 0.48

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 SCHEMBL4609059 1.00 TSHR (0.60) TSHRTP53SRD5A2ALDH1A1CA1
Terephthalic Acid SCHEMBL4605264 0.98 TSHR (0.57) TSHRTP53SRD5A2ALDH1A1CA1
Terephthalic Acid SCHEMBL4605471 0.93 TSHR (0.52) TSHRTP53SRD5A2ALDH1A1CA1
Benzoic Acid SCHEMBL28132510 0.91 TSHR (0.64) TSHRTP53SRD5A2ALDH1A1DAO
Benzoic Acid SCHEMBL14890341 0.91 TSHR (0.64) TSHRTP53SRD5A2ALDH1A1DAO
Terephthalic Acid SCHEMBL4625730 0.83 TSHR (0.46) TSHRTP53SRD5A2ALDH1A1CA1
Terephthalic Acid SCHEMBL7629401 0.83 KMT2A (0.45) TSHRTP53SRD5A2CA1CA2
Isophthalic Acid SCHEMBL4624459 0.82 CA12 (0.52) TSHRTP53CA1CA2CA12
Isophthalic Acid SCHEMBL8125692 0.82 CA12 (0.52) TSHRTP53CA1CA2CA12
Terephthalic Acid SCHEMBL332989 0.81 TSHR (0.71) TSHRTP53SRD5A2ALDH1A1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7101649-B2 Heat-sensitive lithographic printing plate FUJI PHOTO FILM CO., LTD. (JP) 2006-09-05 US disclosed