SCHEMBL9936704

SCHEMBL9936704

COCCOC(=O)COC

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
CA2 P00918 1/20 0.38
DGKA P23743 1/20 0.38
ADRA2A P08913 1/20 0.36
ADRA1A P35348 1/20 0.36
ALDH1A1 P00352 2/20 0.34
MAPT P10636 1/20 0.34
BLM P54132 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
NAAA Q02083 1/20 0.33
CYP2C19 P33261 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HTT P42858 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL13313904 0.93 TSHR (0.39) TSHRCA2DGKAADRA2AADRA1A
SCHEMBL2610085 0.87 TSHR (0.39) TSHRCA2DGKAADRA2AADRA1A
SCHEMBL12050130 0.87 TSHR (0.42) TSHRCA2DGKAADRA2AADRA1A
SCHEMBL18470077 0.87 TSHR (0.39) TSHRCA2DGKAADRA2AADRA1A
SCHEMBL28316299 0.85 GAA (0.50) TSHRALDH1A1GAARAB9ATDP1
SCHEMBL9275566 0.85 TSHR (0.41) TSHRCA2DGKAADRA2AADRA1A
SCHEMBL9936851 0.85 CA2 (0.43) TSHRCA2DGKAADRA2AADRA1A
SCHEMBL12287446 0.84 NAAA (0.48) TSHRCA2DGKAADRA2AADRA1A
SCHEMBL15108347 0.83 TSHR (0.39) TSHRDGKAADRA2AADRA1AALDH1A1
SCHEMBL20862160 0.83 TSHR (0.39) TSHRCA2DGKAADRA2AADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117897378-A Plants with increased tolerance to herbicides 巴斯夫农业种子解决方案美国有限责任公司 2024-04-16 CN disclosed
WO-2023156764-A1 PROCESS JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2023-08-24 WO disclosed
CN-115244035-A Herbicidal phenyluracils 巴斯夫欧洲公司 2022-10-25 CN disclosed
EP-3728235-B1 SUBSTITUTED THIOPHENYLURACILS , THEIR SALTS AND USE OF SAID COMPOUNDS AS HERBICIDAL AGENTS SYNGENTA CROP PROTECTION AG (CH) 2022-02-09 EP disclosed
EP-3692102-B1 HIGH WET FAST DISPERSE DYE MIXTURES DYSTAR COLOURS DISTRIB GMBH (DE) 2021-11-10 EP disclosed
CN-109415289-B Method for producing 2-methoxyacetic acid 巴斯夫欧洲公司 2021-09-03 CN disclosed
US-20210188754-A1 METHOD FOR PRODUCING 2-METHOXYACETIC ACID BASF SE (DE) 2021-06-24 US disclosed
US-20210188754-A1 METHOD FOR PRODUCING 2-METHOXYACETIC ACID BASF SE (DE) 2021-06-24 US disclosed
EP-3475253-B1 METHOD FOR PRODUCING 2-METHOXYACETIC ACID BASF SE (DE) 2020-09-30 EP disclosed
EP-3461861-B1 HIGH WET FAST DISPERSE DYE MIXTURES DYSTAR COLOURS DISTRIB GMBH (DE) 2020-07-15 EP disclosed
US-7635696-B2 Isoxazoline-indole derivatives with an improved antipsychotic and anxiolytic activity JANSSEN PHARMACEUTICA N.V. (BE) 2009-12-22 US disclosed
US-7635696-B2 Isoxazoline-indole derivatives with an improved antipsychotic and anxiolytic activity JANSSEN PHARMACEUTICA N.V. (BE) 2009-12-22 US disclosed
EP-1819713-B1 ISOXAZOLINE-INDOLE DERIVATIVES WITH AN IMPROVED ANTIPSYCHOTIC AND ANXIOLYTIC A IVITY JANSSEN PHARMACEUTICA NV (BE) 2009-09-23 EP disclosed
US-7462717-B2 C6-and C9-substituted chromeno[4,3-c]isoxazoline derivatives and their use as anti-depressants JANSSEN PHARMACEUTICA N.V. (BE) 2008-12-09 US disclosed
US-7462717-B2 C6-and C9-substituted chromeno[4,3-c]isoxazoline derivatives and their use as anti-depressants JANSSEN PHARMACEUTICA N.V. (BE) 2008-12-09 US disclosed
US-7416591-B2 Disperse dye mixtures DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2008-08-26 US disclosed
US-20080113988-A1 Isoxazoline-Indole Derivatives With an Improved Antipsychotic and Anxiolytic Activity JANSSEN PHARMACEUTICA N.V. (BE) 2008-05-15 US disclosed
US-20080113988-A1 Isoxazoline-Indole Derivatives With an Improved Antipsychotic and Anxiolytic Activity JANSSEN PHARMACEUTICA N.V. (BE) 2008-05-15 US disclosed
US-20080022894-A1 Benzo[1,2-b;4,5-b']difuran-2,6-dione derivatives; anthraquinone and monoazo dyes; black shade; synthetic textile material or fiber blend thereof is a polyester, polyester-cellulose, polyester-nylon, polyesterurethane or polyester-wool blend; ink jet printing DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2008-01-31 US disclosed
WO-1982003854-A1 PROCESS FO ENOLYSIS OF CARBOXYLIC ACID ESTERS BRADLEY MICHAEL WILLIAM 1982-11-11 WO 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 (2 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-20210188754-A1 METHOD FOR PRODUCING 2-METHOXYACETIC ACID HAO2, PNMT, MT-CO2 TSHR 3090/4885CA2 44/4885DGKA 626/4885
US-20080113988-A1 Isoxazoline-Indole Derivatives With an Improved Antipsychotic and Anxiolytic Activity HTR3A, HTR2C, HTR5A TSHR 318/4885CA2 2007/4885DGKA 3618/4885

“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.