SCHEMBL28358909

SCHEMBL28358909

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

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.50
DGAT1 O75907 1/20 0.43
ALDH1A1 P00352 5/20 0.41
TSHR P16473 4/20 0.41
USP2 O75604 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 3/20 0.33
HSD17B10 Q99714 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
ELANE P08246 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 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
SCHEMBL26684 1.00
SCHEMBL28745990 1.00 GAA (0.50) GAADGAT1ALDH1A1TSHRUSP2
Iodide SCHEMBL28618721 0.97
SCHEMBL2323786 0.97
Lithium SCHEMBL30387988 0.97
Ammonia Solution, Strong SCHEMBL6253681 0.97
Hydrochloric Acid SCHEMBL4434111 0.97
Phosphine SCHEMBL11162239 0.97
SCHEMBL6500325 0.97
SCHEMBL28869078 0.97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118108709-B Preparation method and application of target CDK19 radionuclide labeling reagent 中国医学科学院放射医学研究所 2026-05-19 CN disclosed
CN-122055172-A Chimeric radiopharmaceuticals targeting the proton-sensitive receptor GPR4 安菲利克斯股份公司 2026-05-15 CN disclosed
CN-120129679-A VHH antibody DOTA conjugates 雅博得乐医疗公司 2025-06-10 CN disclosed
WO-2025087466-A2 LIGAND COMPOUND OF QUINOLINE STRUCTURE, AND RADIOACTIVE OR NON-RADIOACTIVE MARKER THEREOF AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2025-05-01 WO disclosed
WO-2025087229-A1 LIGAND COMPOUND OF QUINOLINE STRUCTURE, RADIOACTIVE OR NON-RADIOACTIVE MARKER, AND USE 四川科伦博泰生物医药股份有限公司 2025-05-01 WO disclosed
CN-119684384-A Nitroreductase response fluorescence and magnetic resonance bimodal probe NO designed based on gemcitabine prodrug2-Cy-Gxtb-Gd-Biotin and synthetic method and application thereof 中国科学院精密测量科学与技术创新研究院 2025-03-25 CN disclosed
CN-115838393-B Intermediate for FAPI synthesis and preparation method and application thereof 烟台蓝纳成生物技术有限公司 2023-05-05 CN disclosed
CN-110753558-A Novel compounds and their therapeutic use 森陶里治疗有限公司 2020-02-04 CN disclosed