Isophthalic Acid

Isophthalic Acid

SCHEMBL9435807

O=C(O)c1cccc(C(=O)O)c1.Oc1ccc(O)cc1

nearest known ligand 0.74

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.74
CA1 P00915 2/20 0.74
CA2 P00918 2/20 0.74
CA6 P23280 2/20 0.74
CA9 Q16790 2/20 0.74
TTR P02766 1/20 0.66
CA3 P07451 1/20 0.64
TYR P14679 1/20 0.64
DRD1 P21728 1/20 0.64
CA4 P22748 1/20 0.64
CA5A P35218 1/20 0.64
CA7 P43166 1/20 0.64
CA14 Q9ULX7 1/20 0.64
CA5B Q9Y2D0 1/20 0.64
CES2 O00748 1/20 0.56
SRD5A2 P31213 1/20 0.56
KMO O15229 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2C9 P11712 1/20 0.56
HPGD P15428 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
Isophthalic Acid SCHEMBL6569118 1.00 CA12 (0.74) CA12CA1CA2CA6CA9
Terephthalic Acid SCHEMBL11040369 0.95 CA12 (0.73) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL28378402 0.95 CA12 (0.73) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL8766630 0.95 CA12 (0.73) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL10456282 0.93 CA1 (0.65) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL4957668 0.93 CA12 (0.78) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL18529299 0.93 CA12 (0.78) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL28884852 0.93 CA12 (0.78) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL147366 0.89 CA12 (0.71) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL20500514 0.89 CA12 (0.71) CA12CA1CA2CA6CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0598039-A1 THERMALLY REVERSIBLE ISOCYANATE-BASED POLYMERS BATTELLE MEMORIAL INSTITUTE (US) 1994-05-25 EP disclosed
WO-1993003080-A2 THERMALLY REVERSIBLE ISOCYANATE-BASED POLYMERS BATTELLE MEMORIAL INSTITUTE (US) 1993-02-18 WO disclosed
EP-0214612-B1 NOVEL POLY(ARYL ETHER)-POLYESTER BLOCK COPOLYMERS AMOCO CORPORATION (US) 1988-11-30 EP disclosed
EP-0214612-A2 Novel poly(aryl ether)-polyester block copolymers AMOCO CORPORATION (US) 1987-03-18 EP disclosed
US-4619975-A HEAT RESISTANCE, CHEMICAL RESISTANCE UNION CARBIDE CORPORATION (US) 1986-10-28 US disclosed
EP-0045499-B1 NOVEL WHOLLY AROMATIC COPOLYESTER, PROCESS FOR PRODUCTION THEREOF, AND FILM MELT-SHAPED THEREFROM TEIJIN LIMITED (JP) 1986-03-05 EP disclosed
US-4436894-A POLYMERIZATION OF MELT FOLLOWED BY SOLID STATE POLYMERIZATION TEIJIN LIMITED (JP) 1984-03-13 US disclosed
EP-0015828-B1 STRESS-CRACK RESISTANT POLYARYLATES AND PROCESS FOR THE PREPARATION UNION CARBIDE CORPORATION (US) 1983-07-13 EP disclosed
EP-0045499-A2 Novel wholly aromatic copolyester, process for production thereof, and film melt-shaped therefrom TEIJIN LIMITED (JP) 1982-02-10 EP disclosed
US-4275188-A POLYESTERS OF TEREPHTHALIC ACID, ISOPHTHALIC ACID, BISPHENOLS AND BIPHENOL ARE MELT PROCESSABLE AND HAVE GOOD SOLVENT RESISTANCE UNION CARBIDE CORPORATION (US) 1981-06-23 US disclosed
EP-0015828-A1 Stress-crack resistant polyarylates and process for the preparation UNION CARBIDE CORPORATION (US) 1980-09-17 EP disclosed