Isophthalic Acid

Isophthalic Acid

SCHEMBL8734977

O=C(O)c1cccc(C(=O)O)c1.OCC1(CO)CCCCC1

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.46
CYP2D6 P10635 1/20 0.46
HIF1A Q16665 1/20 0.46
KMO O15229 2/20 0.46
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA6 P23280 1/20 0.44
CA9 Q16790 1/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
FOLH1 Q04609 1/20 0.43
CYP1A2 P05177 1/20 0.42
MAPT P10636 2/20 0.41
NPC1 O15118 1/20 0.41

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 SCHEMBL247734 0.97 CYP2C9 (0.44) CYP2C9CYP2D6HIF1AKMOCA12
Isophthalic Acid SCHEMBL4650624 0.91 HDAC3 (0.41) CYP2C9CYP2D6HIF1AKMOCA12
Benzoic Acid SCHEMBL25227095 0.89 TSHR (0.52) CYP2C9CYP2D6HIF1AHPGDALDH1A1
Benzoic Acid SCHEMBL1713123 0.89 TSHR (0.52) CYP2C9CYP2D6HIF1AHPGDALDH1A1
SCHEMBL8734973 0.85 RAB9A (0.40) CYP2C9CYP2D6HIF1AKMOCA12
Terephthalic Acid SCHEMBL539238 0.85 TSHR (0.48) CA12CA1CA2CA6CA9
Terephthalic Acid SCHEMBL29389282 0.85 TSHR (0.48) CA12CA1CA2CA6CA9
Terephthalic Acid SCHEMBL28693414 0.85 TSHR (0.48) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL9250674 0.85 ALDH1A1 (0.49) CYP2C9CYP2D6HIF1AKMOCA12
Isophthalic Acid SCHEMBL3722557 0.83 TDP1 (0.39) CYP2C9CYP2D6HIF1AKMOMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0533441-B1 Polycarbonate resin compositions GE PLASTICS JAPAN LTD (JP) 1998-12-09 EP claimed
US-5306767-A Good appearance; chemical resistance GE PLASTICS JAPAN, LTD. (JP) 1994-04-26 US claimed
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
CN-113950508-A Polyester resin composition, molded article, and composite molded article 东丽株式会社 2022-01-18 CN disclosed
CN-111808271-B Bio-based heat-resistant flame-retardant polyester, polyester product, preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2020-12-11 CN disclosed
CN-111808271-A Bio-based heat-resistant flame-retardant polyester, polyester product, preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2020-10-23 CN disclosed
EP-0533441-B1 Polycarbonate resin compositions GE PLASTICS JAPAN LTD (JP) 1998-12-09 EP disclosed
US-5306767-A Good appearance; chemical resistance GE PLASTICS JAPAN, LTD. (JP) 1994-04-26 US disclosed
EP-0533441-A1 Polycarbonate resin compositions GE PLASTICS JAPAN LIMITED (JP) 1993-03-24 EP disclosed
US-4829050-A Solid particle lubricants for slipping layer of dye-donor element used in thermal dye transfer EASTMAN KODAK COMPANY (US) 1989-05-09 US disclosed