Terephthalic Acid

Terephthalic Acid

SCHEMBL28169171

O=C(O)C1(C(=O)O)CC2CCC1C2.O=C(O)c1ccc(C(=O)O)cc1

nearest known ligand 0.40

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
HSD11B1 P28845 1/20 0.40
EPHX2 P34913 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
TP53 P04637 2/20 0.40
TSHR P16473 1/20 0.40
RARA P10276 3/20 0.39
RARB P10826 3/20 0.39
RARG P13631 3/20 0.39
SRD5A2 P31213 3/20 0.37
THRB P10828 1/20 0.37
RECQL P46063 1/20 0.37
NR2E1 Q9Y466 1/20 0.37
EPHX1 P07099 1/20 0.36
LMNA P02545 1/20 0.36
ALOX5AP P20292 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL2761577 0.86 HSD11B1 (0.38) HSD11B1ALOX5AP
Terephthalic Acid SCHEMBL9341496 0.74 ALOX5AP (0.56) HSD11B1MEN1KMT2ARARARARB
SCHEMBL3688895 0.70 HSD11B1 (0.35) HSD11B1
Terephthalic Acid SCHEMBL3691392 0.66 TSHR (0.92) TP53TSHRSRD5A2ALDH1A1ALOX15
SCHEMBL8733039 0.65 HSD11B1 (0.37) HSD11B1ALOX5AP
SCHEMBL422261 0.65 NPC1 (0.56) EPHX2MEN1KMT2ATP53RARA
SCHEMBL21221605 0.65 HSD11B1 (0.38) HSD11B1ALOX5AP
SCHEMBL22441207 0.64 EPHX2 (0.68) EPHX2MEN1KMT2ARARARARB
SCHEMBL23558947 0.64 ALOX5AP (0.45) HSD11B1ALOX5APKDM4E
Terephthalic Acid SCHEMBL28392831 0.63 TSHR (0.86) TP53TSHRSRD5A2ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107073867-B Stacking pipe 宇部兴产株式会社 2019-08-16 CN disclosed
CN-109311259-A Laminated tube 宇部兴产株式会社 2019-02-05 CN disclosed
CN-105517789-B laminated tube 宇部兴产株式会社 2017-10-17 CN disclosed
CN-107148451-A Polyamide composition and molded article formed from same 宇部兴产株式会社 2017-09-08 CN disclosed
CN-107073867-A Stacking pipe 宇部兴产株式会社 2017-08-18 CN disclosed