SCHEMBL5998622

SCHEMBL5998622

CC(=O)CC(C)=O.O=[Ti](O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.45
GAA P10253 1/20 0.45
SI P14410 1/20 0.45
MGAM2 Q2M2H8 1/20 0.45
ALDH1A1 P00352 5/20 0.41
TDP1 Q9NUW8 2/20 0.41
HTT P42858 2/20 0.41
KDM4E B2RXH2 3/20 0.39
KDM6B O15054 1/20 0.39
KDM5C P41229 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
PHF8 Q9UPP1 1/20 0.39
KDM2A Q9Y2K7 1/20 0.39
TRPA1 O75762 1/20 0.39
LMNA P02545 3/20 0.33
SLC15A2 Q16348 1/20 0.33
CA2 P00918 1/20 0.33
PTGS1 P23219 1/20 0.33
MMP12 P39900 1/20 0.33
NFKB1 P19838 1/20 0.32

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
SCHEMBL7581768 1.00 MGAM (0.45) MGAMGAASIMGAM2ALDH1A1
SCHEMBL10389469 0.84 MGAM (0.56) MGAMGAASIMGAM2ALDH1A1
SCHEMBL2128645 0.84 MGAM (0.56) MGAMGAASIMGAM2ALDH1A1
SCHEMBL1608 0.84
Acetoacetic Acid SCHEMBL1508455 0.84 EGLN1 (0.46) MGAMGAASIMGAM2ALDH1A1
SCHEMBL10945228 0.83 MGAM (0.43) MGAMGAASIMGAM2ALDH1A1
Water SCHEMBL23151837 0.81 MGAM (0.53) MGAMGAASIMGAM2ALDH1A1
SCHEMBL21404928 0.81
SCHEMBL9140585 0.81 MGAM (0.53) MGAMGAASIMGAM2ALDH1A1
SCHEMBL21404935 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116368170-A Process for preparing copolyesters 韩华思路信(株) 2023-06-30 CN claimed
CN-114891374-A Solvent-free inorganic nano-silicone resin and preparation method thereof 石家庄戴克科技有限公司 2022-08-12 CN claimed
CN-111518267-B Preparation method and application of bottle-chip-level bio-based 2, 5-furandicarboxylic acid-based copolyester 浙江恒逸石化研究院有限公司 2022-07-08 CN claimed
CN-114456540-A Melamine formaldehyde resin composite material and preparation method thereof 滁州杰事杰新材料有限公司 2022-05-10 CN claimed
CN-113956835-A Organosilicon sealant for U-shaped heating pipe and preparation method thereof 福建省昌德胶业科技有限公司 2022-01-21 CN claimed
CN-111933919-B Nano silicon powder, silicon-based negative electrode, lithium ion battery containing silicon-based negative electrode and manufacturing method of lithium ion battery 拓米(成都)应用技术研究院有限公司 2021-09-28 CN claimed
CN-110003383-B Silicon-titanium hybrid acrylate polymer and dual-curing coating prepared from same 广州五行材料科技有限公司 2021-02-02 CN claimed
CN-112042473-A Preparation method of modified straw suitable for edible fungus cultivation material 蒋亚涛 2020-12-08 CN claimed
CN-111933919-A Nano silicon powder, silicon-based negative electrode, lithium ion battery containing silicon-based negative electrode and manufacturing method of lithium ion battery 拓米(成都)应用技术研究院有限公司 2020-11-13 CN claimed
CN-111909519-A Flexible heat-conducting silicon rubber and preparation method and application thereof 深圳市新亚新材料有限公司 2020-11-10 CN claimed
CN-111518267-A Preparation method and application of bottle-chip-level bio-based 2, 5-furandicarboxylic acid-based copolyester 浙江恒澜科技有限公司 2020-08-11 CN claimed
CN-107513368-B High-temperature-resistant low-expansion-coefficient heat-conducting pouring sealant and preparation method and application thereof 广州天宸高新材料有限公司 2020-03-24 CN claimed
CN-101170988-B Improved oxidative hair dyes and related topical compositions BOOTS CO PLC 2012-10-03 CN claimed
CN-101170988-A Improved oxidative hair dyes and related topical compositions BOOTS CO PLC (GB) 2008-04-30 CN claimed
CN-118355050-A Degradable polyester resin and method for producing the same 可隆工业株式会社 2024-07-16 CN disclosed
CN-118019423-A Perovskite interface passivation method of perovskite solar cell 中节能太阳能科技(镇江)有限公司 2024-05-10 CN disclosed
CN-117940480-A Polyester resins and films comprising recycled bis (2-hydroxyethyl) terephthalate SK化学公司 2024-04-26 CN disclosed
US-5741623-A CYANINE DYE TDK CORPORATION (JP) 1998-04-21 US disclosed
US-4264485-A Insulating coating composition for wire CHEMISCHE FABRIK DR. WIEDEKING (DE) 1981-04-28 US disclosed
US-4228059-A Wire enamel CHEMISCHE FABRIK DR. WIEDEKING (DE) 1980-10-14 US disclosed