SCHEMBL2294428

SCHEMBL2294428

CCOC(=O)C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
LMNA P02545 1/20 0.42
HSD17B10 Q99714 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
GLO1 Q04760 1/20 0.41
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
SOAT1 P35610 1/20 0.40
EGLN1 Q9GZT9 1/20 0.39
MAPT P10636 1/20 0.38
TRPA1 O75762 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
HTT P42858 1/20 0.37
CYP2D6 P10635 1/20 0.36

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
SCHEMBL4317965 0.84 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL3864269 0.82 ALDH1A1 (0.44) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL2992405 0.81 HCAR2 (0.38) ALDH1A1LMNATSHRGAASMN1; SMN2
SCHEMBL9823358 0.81 ALDH1A1 (0.62) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL7262 0.81 ALDH1A1 (0.62) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL1331989 0.81 ALDH1A1 (0.62) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL78520 0.81 DGAT1 (0.46) ALDH1A1TSHRGAASMN1; SMN2MEN1
SCHEMBL6131246 0.81 THRB (0.50) ALDH1A1LMNAHSD17B10NPSR1GLO1
Tert-Butanol SCHEMBL11267233 0.79 ALDH1A1 (0.48) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL18213776 0.78 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10NPSR1GLO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1569803-B Process for preparing aryl beta-diketo acid SHANGHAI INST MATERIA MEDICA 2011-04-13 CN claimed
US-6875740-B1 Combination of a cyclic hexapeptide with antifungal drugs for treatment of fungal pathogens FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2005-04-05 US claimed
CN-1569803-A Process for preparing aryl beta-diketo acid SHANGHAI INST MATERIA MEDICA (CN) 2005-01-26 CN claimed
US-3959312-A Synthesis of antitumor alkaloid deoxyharringtonine and its precursor 3'-0-(5-methyl-2-oxohexanoyl)-cephalotaxine THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1976-05-25 US claimed
EP-4638438-A1 ALPHA4 BETA7 INTEGRIN ANTAGONISTS AND USES THEREOF Xinthera, Inc. (US) 2025-10-29 EP disclosed
EP-4496787-B1 THIOL-OXAMIDE COMPOUNDS AND COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2025-05-28 EP disclosed
US-20250100964-A1 Thiol-Oxamide Compounds and Compositions 3M INNOVATIVE PROPERTIES COMPANY 2025-03-27 US disclosed
US-20240279214-A1 ALPHA4 BETA7 INEGRIN ANTAGONISTS AND USES THEREOF XINTHERA, INC. 2024-08-22 US disclosed
WO-2024138042-A1 ALPHA4 BETA7 INTEGRIN ANTAGONISTS AND USES THEREOF XINTHERA, INC. (US) 2024-06-27 WO disclosed
CN-115427522-B Aqueous resin particle dispersion 爱克发有限公司 2024-05-28 CN disclosed
EP-4237469-B1 CURED ADHESIVE COMPOSITIONS AND METHOD OF MAKING SOLVENTUM INTELLECTUAL PROPERTIES COMPANY (US) 2024-05-15 EP disclosed
CN-116390970-B Cured adhesive composition and method of making the same 舒万诺知识产权公司 2024-04-26 CN disclosed
US-5256798-A Treating beta-anomer ribofuranosyl sulfonate with source of conjugate anion ELI LILLY AND COMPANY (US) 1993-10-26 US disclosed
EP-0075600-B1 2-THIAZOLEAMINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND MEDICINAL COMPOSITION CONTAINING SAME MITSUI TOATSU CHEMICALS, Inc. (JP) 1986-12-30 EP disclosed
US-4532137-A Treating immunodisease by administering immunomodulator MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1985-07-30 US disclosed
US-4473577-A ANTIARTHRITIC AGENTS ANTIINFLAMMATORY AGENTS MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1984-09-25 US disclosed
EP-0021676-B1 3-METHOXY-2-OXOAZETIDINE DERIVATIVES AND THEIR PRODUCTION Takeda Chemical Industries, Ltd. (JP) 1983-09-14 EP disclosed
EP-0075600-A1 2-THIAZOLEAMINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND MEDICINAL COMPOSITION CONTAINING SAME MITSUI TOATSU CHEMICALS, Inc. (JP) 1983-04-06 EP disclosed
US-3959312-A Synthesis of antitumor alkaloid deoxyharringtonine and its precursor 3'-0-(5-methyl-2-oxohexanoyl)-cephalotaxine THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1976-05-25 US disclosed
US-3959312-A Synthesis of antitumor alkaloid deoxyharringtonine and its precursor 3'-0-(5-methyl-2-oxohexanoyl)-cephalotaxine THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1976-05-25 US 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-20240279214-A1 ALPHA4 BETA7 INEGRIN ANTAGONISTS AND USES THEREOF ITGB7, ITGB4, ITGA4 ALDH1A1 1190/4885LMNA 3808/4885HSD17B10 3749/4885
US-20250100964-A1 Thiol-Oxamide Compounds and Compositions TMT1A, TST, SULT1E1 ALDH1A1 110/4885LMNA 4510/4885HSD17B10 1937/4885

“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.