SCHEMBL69027

SCHEMBL69027

O=C(O)Cc1ccc(CC(=O)O)c2ccccc12

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.69
AKR1B1 P15121 2/20 0.60
CXCL8 P10145 4/20 0.48
KDM4E B2RXH2 3/20 0.47
GAA P10253 3/20 0.47
ALDH1A1 P00352 2/20 0.47
GLA P06280 1/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
LMNA P02545 2/20 0.46
ABCC4 O15439 1/20 0.46
TSHR P16473 1/20 0.46
PTGS1 P23219 1/20 0.46
HTT P42858 1/20 0.46
CAMK2A Q9UQM7 1/20 0.46
BCAT2 O15382 1/20 0.46
MAPT P10636 1/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44

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
SCHEMBL29732929 1.00 TDP1 (0.69) TDP1AKR1B1CXCL8KDM4EGAA
SCHEMBL21585561 0.93 TDP1 (0.62) TDP1AKR1B1CXCL8KDM4EGAA
SCHEMBL29564952 0.90 TDP1 (0.76) TDP1AKR1B1CXCL8KDM4EGLA
SCHEMBL69234 0.90 TDP1 (0.76) TDP1AKR1B1CXCL8KDM4EGLA
SCHEMBL6741607 0.89 AKR1B1 (0.61) TDP1AKR1B1CXCL8KDM4EGAA
SCHEMBL17537563 0.88 TDP1 (0.56) TDP1AKR1B1CXCL8KDM4EALDH1A1
SCHEMBL17537567 0.88 TDP1 (0.56) TDP1AKR1B1
SCHEMBL13912445 0.88 TDP1 (0.56) TDP1AKR1B1CXCL8KDM4EGAA
SCHEMBL28776504 0.88 TDP1 (0.56) TDP1AKR1B1CXCL8PTGS1CAMK2A
SCHEMBL694981 0.88 TDP1 (0.56) TDP1AKR1B1CXCL8KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114634615-B Polycarbonate-polyester copolymer with low dielectric constant, high weather resistance and high impact resistance 万华化学集团股份有限公司 2023-10-20 CN claimed
CN-116813473-A Prepolymer, preparation method, michael addition coating with root inhibition effect and waterproof coating 佛山市科顺建筑材料有限公司 2023-09-29 CN claimed
CN-114634615-A Polycarbonate-polyester copolymer with low dielectric constant, high weather resistance and high impact resistance 万华化学集团股份有限公司 2022-06-17 CN claimed
CN-116813473-B Prepolymer, preparation method, michael addition coating with root inhibition effect and waterproof coating 佛山市科顺建筑材料有限公司 2023-12-08 CN disclosed
CN-114634615-B Polycarbonate-polyester copolymer with low dielectric constant, high weather resistance and high impact resistance 万华化学集团股份有限公司 2023-10-20 CN disclosed
CN-116813473-A Prepolymer, preparation method, michael addition coating with root inhibition effect and waterproof coating 佛山市科顺建筑材料有限公司 2023-09-29 CN disclosed
CN-114634615-A Polycarbonate-polyester copolymer with low dielectric constant, high weather resistance and high impact resistance 万华化学集团股份有限公司 2022-06-17 CN disclosed
US-11220475-B2 Monomers from biomass NDSU RESEARCH FOUNDATION (US) 2022-01-11 US disclosed
US-20210198175-A9 NOVEL MONOMERS FROM BIOMASS NDSU RESEARCH FOUNDATION (US) 2021-07-01 US disclosed
US-20200140368-A1 NOVEL MONOMERS FROM BIOMASS NDSU RESEARCH FOUNDATION (US) 2020-05-07 US disclosed
US-20180093939-A9 NOVEL MONOMERS FROM BIOMASS NDSU RESEARCH FOUNDATION (US) 2018-04-05 US disclosed
CN-100357270-C D-proline derivative HOFFMANN LA ROCHE (CH) 2007-12-26 CN disclosed
US-6740760-B2 SUCH AS 1-((S)-3-MERCAPTO-2-METHYL-PROPIONYL)-(R)-PYRROL-IDINE-2-CARBOXYLIC ACID FOR TREATING DISEASES ASSOCIATED WITH AMYLOIDOSIS (ALZHEIMER'S DISEASE, DIABETES, AND FAMILIAL AMYLOID POLYNEUROPATHY) HOFFMANN-LA ROCHE INC. 2004-05-25 US disclosed
US-20030100770-A1 Such as 1-((S)-3-mercapto-2-methyl-propionyl)-(R)-pyrrol-idine-2-carboxylic acid for treating diseases associated with amyloidosis (Alzheimer's disease, diabetes, and familial amyloid polyneuropathy) PENTRAXIN THERAPEUTICS LTD. (GB) 2003-05-29 US disclosed
US-6512001-B1 To treat diseases associated with amyloidosis, such as Alzheimer's disease HOFFMANN-LA ROCHE INC. 2003-01-28 US disclosed
EP-0915088-B1 D-Proline derivatives HOFFMANN LA ROCHE (CH) 2002-09-18 EP disclosed
US-6262089-B1 USING THESE COMPOUNDS TO TREAT DISEASES ASSOCIATED WITH AMYLOIDOSIS, SUCH AS ALZHEIMER'S DISEASE, MATURITY ONSET DIABETES MELLITUS, FAMILIAL AMYLOID POLYNEUROPATHY, SCRAPIE, AND KREUZFELD-JACOB DISEASE. HOFFMAN-LA ROCHE INC. 2001-07-17 US disclosed
US-6103910-A FOR TREATMENT OF DISEASES ASSOCIATED WITH AMYLOIDOSIS, SUCH AS ALZHEIMER'S DISEASE, DIABETES MELLITUS, FAMILIAL AMYLOID POLYNEUROPATHY, SCRAPIE, AND KREUZFELD-JACOB DISEASE HOFFMANN-LA ROCHE INC. (US) 2000-08-15 US disclosed
CN-1217327-A D-proline derivative HOFFMANN LA ROCHE (CH) 1999-05-26 CN disclosed
EP-0915088-A1 D-Proline derivatives F. HOFFMANN-LA ROCHE AG (CH) 1999-05-12 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030100770-A1 Such as 1-((S)-3-mercapto-2-methyl-propionyl)-(R)-pyrrol-idine-2-carboxylic acid for treating diseases associated with amyloidosis (Alzheimer's disease, diabetes, and familial amyloid polyneuropathy) PSEN1, PSEN2, IAPP TDP1 892/4885AKR1B1 34/4885CXCL8 4712/4885
US-20210198175-A9 NOVEL MONOMERS FROM BIOMASS DCXR, MANBA, PGLS TDP1 2448/4885AKR1B1 1678/4885CXCL8 3617/4885
US-20180093939-A9 NOVEL MONOMERS FROM BIOMASS DCXR, MANBA, PGLS TDP1 2448/4885AKR1B1 1678/4885CXCL8 3617/4885
US-20200140368-A1 NOVEL MONOMERS FROM BIOMASS DCXR, MANBA, PGLS TDP1 2448/4885AKR1B1 1678/4885CXCL8 3617/4885
US-11220475-B2 Monomers from biomass DCXR, MGAM, ALG1 TDP1 1471/4885AKR1B1 1227/4885CXCL8 3561/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.