Terephthalic Acid

Terephthalic Acid

SCHEMBL6892927

O=C(O)CCCCC(=O)O.O=C(O)c1ccc(C(=O)O)cc1.O=C(O)c1cccc(C(=O)O)c1.OCCCCO

nearest known ligand 0.51

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
GPR84 Q9NQS5 1/20 0.50
FFAR1 O14842 1/20 0.50
FFAR4 Q5NUL3 1/20 0.50
HDAC3 O15379 1/20 0.49
HDAC4 P56524 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
HDAC9 Q9UKV0 1/20 0.49
HDAC5 Q9UQL6 1/20 0.49
PPARA Q07869 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44

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 SCHEMBL10681045 0.98 GPR84 (0.48) GPR84FFAR1FFAR4HDAC3HDAC4
Isophthalic Acid SCHEMBL28864205 0.96 GPR84 (0.54) GPR84FFAR1FFAR4HDAC3HDAC4
Terephthalic Acid SCHEMBL10681042 0.95 GPR84 (0.46) GPR84FFAR1FFAR4HDAC3HDAC4
Isophthalic Acid SCHEMBL29100400 0.95 GPR84 (0.57) GPR84FFAR1FFAR4HDAC3HDAC4
Isophthalic Acid SCHEMBL2380785 0.95 GPR84 (0.57) GPR84FFAR1FFAR4HDAC3HDAC4
Azelaic Acid SCHEMBL11389879 0.95 GPR84 (0.57) GPR84FFAR1FFAR4HDAC3HDAC4
Azelaic Acid SCHEMBL11383276 0.93 HDAC3 (0.53) GPR84FFAR1FFAR4HDAC3HDAC4
Sebacic Acid SCHEMBL11778565 0.93 HDAC3 (0.53) GPR84FFAR1FFAR4HDAC3HDAC4
Terephthalic Acid SCHEMBL3334284 0.93 HDAC3 (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
Isophthalic Acid SCHEMBL2419522 0.91 HDAC3 (0.53) GPR84FFAR1FFAR4HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6743741-B1 Process for producing adhesive for fusion bonding, adhesive for fusion bonding obtained by the process, and adhesive fabric containing the adhesive for fusion bonding SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2004-06-01 US disclosed
EP-1231247-A1 PROCESS FOR PRODUCING ADHESIVE FOR FUSION BONDING, ADHESIVE FOR FUSION BONDING OBTAINED BY THE PROCESS, AND ADHESIVE FABRIC CONTAINING THE ADHESIVE FOR FUSION BONDING SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2002-08-14 EP disclosed