Isophthalic Acid

Isophthalic Acid

SCHEMBL1325825

O=C(O)CCCCC(=O)O.O=C(O)c1cccc(C(=O)O)c1.O=C1OCCOC(=O)c2ccc1cc2

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC18A2SLC6A2SLC6A3

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 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
KMO O15229 2/20 0.40
TDP2 O95551 1/20 0.39
PPARA Q07869 1/20 0.39
PKM P14618 1/20 0.39
TSHR P16473 1/20 0.39
APEX1 P27695 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39

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
Azelaic Acid SCHEMBL10396106 0.99 HDAC3 (0.45) HDAC3HDAC4HDAC1HDAC7HDAC2
Isophthalic Acid SCHEMBL1325894 0.96 HDAC3 (0.41) HDAC3HDAC4HDAC1HDAC7HDAC2
Sebacic Acid SCHEMBL1326195 0.94 HDAC3 (0.44) HDAC3HDAC4HDAC1HDAC7HDAC2
Isophthalic Acid SCHEMBL1324997 0.90 ALDH1A1 (0.44) SMN1; SMN2KMOTDP2PKMTSHR
Terephthalic Acid SCHEMBL9267638 0.89 HDAC3 (0.42) HDAC3HDAC4HDAC1HDAC7HDAC2
Isophthalic Acid SCHEMBL170729 0.89 KMO (0.48) KMOTDP2CA12CA1CA2
Adipic Acid SCHEMBL9017423 0.88 SMN1; SMN2 (0.44) HDAC3HDAC4HDAC1HDAC7HDAC2
Adipic Acid SCHEMBL1325137 0.87 HDAC3 (0.44) HDAC3HDAC4HDAC1HDAC7HDAC2
Terephthalic Acid SCHEMBL28482093 0.87 SMN1; SMN2 (0.42) HDAC3HDAC4HDAC1HDAC7HDAC2
Isophthalic Acid SCHEMBL374460 0.86 KMO (0.46) SMN1; SMN2KMOCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3970942-B1 COMPOSITE MOLDED ARTICLE TORAY INDUSTRIES (JP) 2024-03-27 EP disclosed
CN-109757104-B Thermoplastic resin composition and metal joint and method for producing same 东丽先端材料研究开发(中国)有限公司 2023-10-13 CN disclosed
US-20230174837-A1 THERMALLY CONDUCTIVE RESIN COMPOSITION AND MOLDED ARTICLE COMPRISING SAME TOYOBO CO., LTD. (JP) 2023-06-08 US disclosed
US-11578185-B2 Polyester resin composition, molded article, and composite molded article TORAY INDUSTRIES, INC. (JP) 2023-02-14 US disclosed
US-20220145044-A1 POLYESTER RESIN COMPOSITION, MOLDED ARTICLE, AND COMPOSITE MOLDED ARTICLE TORAY INDUSTRIES, INC. (JP) 2022-05-12 US disclosed
US-11319436-B2 Thermoplastic polyester resin composition and molded article TORAY INDUSTRIES, INC. (JP) 2022-05-03 US disclosed
US-20200172726-A1 THERMOPLASTIC POLYESTER RESIN COMPOSITION AND MOLDED ARTICLE TORAY INDUSTRIES, INC. (JP) 2020-06-04 US disclosed
US-20200171724-A1 COMPOSITE MOLDED ARTICLE AND METHOD OF PRODUCING SAME TORAY INDUSTRIES, INC. (JP) 2020-06-04 US disclosed
EP-3031860-B1 PREPREG BASED ON AN EPOXY RESIN COMPOSITION, AND FIBER-REINFORCED COMPOSITE MATERIAL TORAY INDUSTRIES (JP) 2019-09-25 EP disclosed
US-10239970-B2 Method of producing fine particles of non-vinyl thermoplastic polymer TORAY INDUSTRIES, INC. (JP) 2019-03-26 US disclosed
US-8193264-B2 Thermoplastic resin composition and molded article thereof TORAY INDUSTRIES, INC. (JP) 2012-06-05 US disclosed
US-20110275743-A1 FLAME-RETARDANT THERMOPLASTIC RESIN COMPOSITION AND MOLDED ARTICLE TORAY INDUSTRIES, INC. (JP) 2011-11-10 US disclosed
US-20110070442-A1 METHOD FOR PRODUCING POLYMER FINE PARTICLE TORAY INDUSTRIES, INC. (JP) 2011-03-24 US disclosed
US-20090275678-A1 THERMOPLASTIC RESIN COMPOSITION AND MOLDED ARTICLE THEREOF TORAY INDUSTRIES, INC. (JP) 2009-11-05 US disclosed
EP-2036952-A1 THERMOPLASTIC RESIN COMPOSITION AND MOLDED ARTICLE THEREOF Toray Industries, Inc. (JP) 2009-03-18 EP disclosed
EP-0536952-B1 Method of draw-forming a metal sheet having an organic film TOYO SEIKAN KAISHA LTD (JP) 1995-12-13 EP disclosed
EP-0536952-A1 Method of draw-forming a metal sheet having an organic film TOYO SEIKAN KAISHA LIMITED (JP) 1993-04-14 EP disclosed
US-4535049-A Pressure-fixing toner for electrophotography and process for preparation thereof MITA INDUSTRIAL CO., LTD. (JP) 1985-08-13 US disclosed
US-4415645-A PARTICLES OF A WAXY FIXATIVE DISPERSED IN A MOMOGENOUS MIXTURE OF RESIN AND PIGMENT; ANTIFOGGING AGENTS; TRANSFERRING MITA INDUSTRIAL COMPANY LIMITED (JP) 1983-11-15 US disclosed
US-4357406-A EMULSIFICATION, FIXING MITA INDUSTRIAL COMPANY LIMITED (JP) 1982-11-02 US disclosed