Terephthalic Acid

Terephthalic Acid

SCHEMBL28622229

CCCOC(=O)c1ccc(C(=O)OCCC)cc1.CCCOC(=O)c1ccc(C(=O)OCCC)cc1.O=C(O)c1ccc(C(=O)O)cc1

nearest known ligand 0.75

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
LMNA P02545 3/20 0.75
ALDH1A1 P00352 7/20 0.72
TSHR P16473 4/20 0.72
ESR1 P03372 2/20 0.72
TDP1 Q9NUW8 2/20 0.72
CHRM1 P11229 1/20 0.72
SLC6A2 P23975 1/20 0.72
KDR P35968 1/20 0.72
MAPT P10636 4/20 0.59
STS P08842 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
CYP1A2 P05177 2/20 0.58
CYP2C19 P33261 2/20 0.58
CYP2D6 P10635 1/20 0.58
MAPK1 P28482 1/20 0.58
NR1H2 P55055 1/20 0.58
RNASEL Q05823 1/20 0.58
HPGD P15428 2/20 0.57
CYP3A4 P08684 1/20 0.56
CYP2C9 P11712 1/20 0.56

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
SCHEMBL1995221 1.00 LMNA (0.75) LMNAALDH1A1TSHRESR1TDP1
SCHEMBL9726247 0.98 LMNA (0.72) LMNAALDH1A1TSHRESR1TDP1
Butanedione SCHEMBL28991330 0.94 LMNA (0.68) LMNAALDH1A1TSHRESR1TDP1
Propylparaben SCHEMBL1078677 0.93 ESR1 (0.86) LMNAALDH1A1TSHRESR1TDP1
Benzoic Acid SCHEMBL29000838 0.92 LMNA (0.89) LMNAALDH1A1TSHRESR1TDP1
SCHEMBL49950 0.92 ALDH1A1 (0.84) LMNAALDH1A1TSHRESR1TDP1
Propylparaben SCHEMBL28614294 0.91 ESR1 (0.83) LMNAALDH1A1TSHRESR1TDP1
SCHEMBL28758641 0.90 ALDH1A1 (0.81) LMNAALDH1A1TSHRESR1TDP1
SCHEMBL27667930 0.90 ALDH1A1 (0.81) LMNAALDH1A1TSHRESR1TDP1
SCHEMBL27647586 0.90 ALDH1A1 (0.81) LMNAALDH1A1TSHRESR1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113430159-A Bionic extracellular matrix bioactive substance coating polyester reticular lamellar scaffold 广东乾晖生物科技有限公司 2021-09-24 CN claimed
CN-113430159-B Bionic extracellular matrix bioactive substance coating polyester reticular lamellar scaffold 广东乾晖生物科技有限公司 2022-04-12 CN disclosed
CN-113430159-A Bionic extracellular matrix bioactive substance coating polyester reticular lamellar scaffold 广东乾晖生物科技有限公司 2021-09-24 CN disclosed