Isophthalic Acid

Isophthalic Acid

SCHEMBL6264265

O=C([O-])c1cccc(C(=O)[O-])c1.[Ca+2]

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Isophthalic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 11/20 0.59
CA4 P22748 1/20 0.59
ATM Q13315 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
USP2 O75604 1/20 0.45
CA1 P00915 10/20 0.44
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
CA12 O43570 1/20 0.41
CA6 P23280 1/20 0.41
CA9 Q16790 1/20 0.41
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 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
Isophthalic Acid SCHEMBL15572636 0.95 CA2 (0.54) CA2CA4ATMTDP1L3MBTL1
Isophthalic Acid SCHEMBL106980 0.94 CA2 (0.67) CA2CA4ATMTDP1L3MBTL1
Isophthalic Acid SCHEMBL4450604 0.94 CA2 (0.59) CA2CA4ATMTDP1L3MBTL1
Isophthalic Acid SCHEMBL11292198 0.94 CA2 (0.59) CA2CA4ATMTDP1L3MBTL1
Isophthalic Acid SCHEMBL23035003 0.94 CA2 (0.59) CA2CA4ATMTDP1L3MBTL1
Isophthalic Acid SCHEMBL23035004 0.94 CA2 (0.59) CA2CA4ATMTDP1L3MBTL1
Isophthalic Acid SCHEMBL105996 0.94 CA2 (0.59) CA2CA4ATMTDP1L3MBTL1
Isophthalic Acid SCHEMBL25202017 0.94 CA2 (0.59) CA2CA4ATMTDP1L3MBTL1
Isophthalic Acid SCHEMBL3684094 0.94 CA2 (0.59) CA2CA4ATMTDP1L3MBTL1
Isophthalic Acid SCHEMBL161261 0.94 CA2 (0.59) CA2CA4ATMTDP1L3MBTL1

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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1593712-A1 FLAME-RETARDANT POLYCARBONATE RESIN COMPOSITION DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) 2005-11-09 EP claimed
JP-59219332-A None JP disclosed
WO-2024019466-A1 ORGANIC-INORGANIC NANOPOROUS ADSORBENT CONTAINING HYDROXY LIGAND AND METHOD FOR PREPARING SAME 한국생산기술연구원 2024-01-25 WO disclosed
CN-112029108-B Nano MOF material and preparation method and application thereof 曾能 2022-05-03 CN disclosed
CN-110952161-B Low-melting-point elastic polyester fiber and preparation method thereof 扬州富威尔复合材料有限公司 2021-06-29 CN disclosed
CN-106471061-B Polylactic acid composition, molded body obtained from polylactic acid composition, and method for producing polylactic acid composition 帝人株式会社 2021-06-08 CN disclosed
CN-110952168-B Low-content organic volatile matter and low-melting-point polyester fiber and preparation method thereof 扬州富威尔复合材料有限公司 2021-05-28 CN disclosed
US-11001707-B2 Polylactic acid composition, formed article obtained from polylactic acid composition, and method for producing polylactic acid composition TEIJIN LIMITED (JP) 2021-05-11 US disclosed
CN-112029108-A Nano MOF material and preparation method and application thereof 曾能 2020-12-04 CN disclosed
CN-107810231-B Polymer composition comprising linear low density polyethylene SABIC环球技术有限责任公司 2020-10-16 CN disclosed
WO-1993020270-A1 GASKET MATERIAL HOLLINGSWORTH & VOSE COMPANY (US) 1993-10-14 WO disclosed
US-5240766-A Fiber, elastomeric binder and a solid filler HOLLINGSWORTH & VOSE COMPANY (US) 1993-08-31 US disclosed
US-4490522-A REACTING POLYHALOGENATED AROMATIC COMPOUND WITH ALKALI METAL SULFIDE IN PRESENCE OF OXYALKYLENE COMPOUND DAINIPPON INK & CHEMICALS, INC. (JP) 1984-12-25 US disclosed
JP-S59219332-A PRODUCTION OF POLYPHENYLENE SULFIDE DAINIPPON INK & CHEM INC 1984-12-10 JP disclosed
EP-0011607-B1 METALLIC CHROMATE PIGMENT COMPOSITIONS AND PROCESS FOR PREPARING THEM CIBA-GEIGY AG (CH) 1981-09-02 EP disclosed
US-4247338-A BLENDING WITH PLASTICIZERS, ZINC, CALCIUM SALTS OF CARBOXYLIC ACIDS CIBA-GEIGY CORPORATION (US) 1981-01-27 US disclosed
EP-0011607-A1 Metallic chromate pigment compositions and process for preparing them CIBA-GEIGY AG (CH) 1980-05-28 EP disclosed
US-3985797-A Hydroxylation of aromatic compounds UOP INC. (US) 1976-10-12 US disclosed
US-3985796-A Hydroxylation of aromatic compounds UOP INC. (US) 1976-10-12 US disclosed
US-3931295-A Hydroxylation of aromatic compounds UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-01-06 US disclosed