Terephthalic Acid

Terephthalic Acid

SCHEMBL216498

C=C(C)C(=O)O.O=C(O)c1ccc(C(=O)O)cc1.OCC(CO)(CO)CO

nearest known ligand 0.46

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 0.46
TP53 P04637 1/20 0.46
ALDH1A1 P00352 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
POLB P06746 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
APEX1 P27695 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 2/20 0.42
SRD5A2 P31213 3/20 0.41
CA1 P00915 3/20 0.40
CA2 P00918 3/20 0.40
CA12 O43570 1/20 0.40
CA3 P07451 1/20 0.40
TYR P14679 1/20 0.40
DRD1 P21728 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40

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
Benzoic Acid SCHEMBL3410022 0.93 TSHR (0.50) TSHRTP53ALDH1A1SMN1; SMN2POLB
Terephthalic Acid SCHEMBL2687529 0.85 TSHR (0.63) TSHRTP53ALDH1A1SMN1; SMN2SRD5A2
Terephthalic Acid SCHEMBL28859780 0.85 TSHR (0.63) TSHRTP53ALDH1A1SMN1; SMN2POLB
Terephthalic Acid SCHEMBL10736240 0.85 TSHR (0.63) TSHRTP53ALDH1A1SMN1; SMN2POLB
Terephthalic Acid SCHEMBL11490240 0.85 TSHR (0.63) TSHRTP53ALDH1A1SMN1; SMN2SRD5A2
Terephthalic Acid SCHEMBL8506032 0.85 TSHR (0.63) TSHRTP53ALDH1A1SMN1; SMN2SRD5A2
Benzoic Acid SCHEMBL28085428 0.84 DAO (0.45) TSHRALDH1A1SMN1; SMN2POLBTDP1
Benzoic Acid SCHEMBL4117667 0.84 DAO (0.45) TSHRALDH1A1SMN1; SMN2POLBTDP1
Methacrylic Acid SCHEMBL609551 0.83 TDP1 (0.36) TSHRTP53ALDH1A1SMN1; SMN2TDP1
Methacrylic Acid SCHEMBL2231460 0.83 TDP1 (0.36) TSHRTP53ALDH1A1SMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101805281-B Oxime ester compound and photosensitive polymer composition using same NIPPON CHEMICAL WORKS 2014-03-05 CN disclosed
US-8088836-B2 Oxime ester compounds and photosensitive resin compositions using the same NIPPON CHEMICAL WORKS CO., LTD. (JP) 2012-01-03 US disclosed
US-20100210749-A1 Oxime ester compounds and photosensitive resin compositions using the same NIPPON CHEMICAL WORKS CO., LTD. 2010-08-19 US disclosed
CN-101805281-A Oxime ester compound to used for photosensitive polymer composition NIPPON CHEMICAL WORKS 2010-08-18 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100210749-A1 Oxime ester compounds and photosensitive resin compositions using the same PPOX, FTO, NR2E3 TSHR 3863/4885TP53 3737/4885ALDH1A1 656/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.