Terephthalic Acid

Terephthalic Acid

SCHEMBL10383285

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

nearest known ligand 0.55

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 5/20 0.55
TP53 P04637 2/20 0.55
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
RARB P10826 1/20 0.49
PKM P14618 1/20 0.48
SRD5A2 P31213 2/20 0.48
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
CA12 O43570 1/20 0.46
CA3 P07451 1/20 0.46
TYR P14679 1/20 0.46
DRD1 P21728 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
CA5B Q9Y2D0 1/20 0.46

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 SCHEMBL674458 1.00 TSHR (0.55) TSHRTP53MEN1KMT2ARARB
Terephthalic Acid SCHEMBL27506116 1.00 TSHR (0.55) TSHRTP53MEN1KMT2ARARB
Tetraethylene Glycol SCHEMBL3841162 1.00 TSHR (0.55) TSHRTP53MEN1KMT2ARARB
Terephthalic Acid SCHEMBL31548541 0.98 TSHR (0.52) TSHRTP53MEN1KMT2ARARB
Terephthalic Acid SCHEMBL375131 0.98 TSHR (0.57) TSHRTP53MEN1KMT2ARARB
Terephthalic Acid SCHEMBL6554172 0.98 TSHR (0.57) TSHRTP53MEN1KMT2ARARB
Terephthalic Acid SCHEMBL9165497 0.95 TSHR (0.55) TSHRTP53MEN1KMT2ARARB
Paraben SCHEMBL3364114 0.92 CA2 (0.61) TSHRTP53MEN1KMT2ARARB
Triethylene Glycol SCHEMBL5730892 0.91 TSHR (0.58) TSHRTP53MEN1KMT2ARARB
Triethylene Glycol SCHEMBL205789 0.91 TSHR (0.58) TSHRTP53MEN1KMT2ARARB

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-4931524-A SACCHARIDE/URETHANE ETHER WITH PARTIAL BLOCKING AND HYDRO-PHILIC MOIETY; ETHERIFICATION DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1990-06-05 US disclosed