Itaconate

Itaconate

SCHEMBL4294336

C=C(CC(=O)O)C(=O)O.C=CC=C

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.77
HSD17B10 Q99714 1/20 0.77
LDHA P00338 1/20 0.40
SRR Q9GZT4 1/20 0.40
TSHR P16473 2/20 0.37
KDM4E B2RXH2 1/20 0.37
TET2 Q6N021 5/20 0.36
TET3 O43151 1/20 0.36
TET1 Q8NFU7 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GRIK1 P39086 1/20 0.34
GRIK2 Q13002 1/20 0.34
GRM1 Q13255 1/20 0.34
GRM2 Q14416 1/20 0.34
LMNA P02545 1/20 0.32
ABCC4 O15439 1/20 0.30
MAPT P10636 1/20 0.30

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
Itaconate SCHEMBL11346891 0.93 ALOX15 (0.68) ALOX15HSD17B10LDHASRRTSHR
Itaconate SCHEMBL3625755 0.90 ALOX15 (0.77) ALOX15HSD17B10LDHASRRTSHR
Itaconate SCHEMBL29886131 0.89
Itaconate SCHEMBL21523 0.89
Itaconate SCHEMBL286967 0.89 ALOX15 (0.75) ALOX15HSD17B10LDHASRRTSHR
Itaconate SCHEMBL29663337 0.87 ALOX15 (1.00) ALOX15HSD17B10LDHASRRTSHR
Itaconate SCHEMBL27498028 0.87 ALOX15 (0.74) ALOX15HSD17B10LDHASRRTSHR
Itaconate SCHEMBL3821311 0.87 ALOX15 (1.00) ALOX15HSD17B10LDHASRRTSHR
Itaconate SCHEMBL17073956 0.87 ALOX15 (0.61) ALOX15HSD17B10LDHASRRTSHR
Itaconate SCHEMBL18554417 0.86 ALOX15 (0.71) ALOX15HSD17B10LDHASRRTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7214463-B2 Toner processes XEROX CORPORATION (US) 2007-05-08 US claimed
US-20060166122-A1 Toner processes XEROX CORPORATION 2006-07-27 US claimed
CN-119331170-A Integrated functionalized itaconate/butadiene/isoprene bio-based rubber and vulcanized rubber and preparation method thereof 北京化工大学 2025-01-21 CN disclosed
CN-119331169-A Itaconate/conjugated diene/terpene multi-component copolymerization type bio-based rubber and vulcanized rubber and preparation method thereof 北京化工大学 2025-01-21 CN disclosed
CN-117417494-A Carboxyl styrene-butadiene latex with core-shell structure and preparation method thereof 江苏亚泰化工有限公司 2024-01-19 CN disclosed
CN-115151868-A Photosensitive resin composition, method for sorting photosensitive resin composition, method for producing patterned cured film, and method for producing semiconductor device 昭和电工材料株式会社 2022-10-04 CN disclosed
CN-104221184-B Secondary cell dividing plate 日本瑞翁株式会社 2016-10-05 CN disclosed
US-20130095254-A1 IMAGE-RECORDING COMPOSITION, IMAGE-RECORDING APPARATUS, AND IMAGE-RECORDING METHOD FUJI XEROX CO., LTD. (JP) 2013-04-18 US disclosed
US-8399133-B2 Electrode assembly and secondary battery having the same SAMSUNG SDI CO., LTD. (KR) 2013-03-19 US disclosed
US-20090181300-A1 ELECTRODE ASSEMBLY AND SECONDARY BATTERY HAVING THE SAME SAMSUNG SDI CO., LTD. (KR) 2009-07-16 US disclosed
EP-2079121-A1 Electrode Assembly and Secondary Battery having the same Samsung SDI Co., Ltd. (KR) 2009-07-15 EP disclosed
US-7214463-B2 Toner processes XEROX CORPORATION (US) 2007-05-08 US disclosed
US-20060166122-A1 Toner processes XEROX CORPORATION 2006-07-27 US disclosed
US-5171768-A Continuous processing in four zones; selective addition of conjugated diene to partially polymerized non-carboxylic monomer; butadiene-itaconic acid-butadiene terpolymer THE GOODYEAR TIRE & RUBBER COMPANY (US) 1992-12-15 US disclosed