SCHEMBL29391817

SCHEMBL29391817

CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)NCC=O)[C@@H](C)O.[O-2]

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 4/20 0.44
▸ KEAP1 Q14145 3/20 0.42
▸ STAT3 P40763 1/20 0.42
▸ SLC6A2 P23975 1/20 0.41
▸ CALCRL Q16602 3/20 0.41
▸ NTSR2 O95665 3/20 0.40
▸ NTSR1 P30989 3/20 0.40
▸ SORT1 Q99523 3/20 0.40
▸ CTSB P07858 1/20 0.40
▸ RAMP3 O60896 2/20 0.39
▸ CALCR P30988 2/20 0.39

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
SCHEMBL30449622 0.90 KEAP1 (0.48) CAPN1KEAP1STAT3SLC6A2CALCRL
SCHEMBL29498765 0.88 CAPN1 (0.48) CAPN1STAT3SLC6A2CALCRLNTSR2
SCHEMBL8626712 0.88 SLC6A2 (0.49) CAPN1STAT3SLC6A2CALCRLNTSR2
SCHEMBL8627850 0.88 SLC6A2 (0.49) CAPN1STAT3SLC6A2CALCRLNTSR2
SCHEMBL22342218 0.87 KEAP1 (0.54) KEAP1CALCRLRAMP3CALCR
SCHEMBL30335608 0.87 KEAP1 (0.49) CAPN1KEAP1STAT3SLC6A2CALCRL
SCHEMBL26186023 0.87 KEAP1 (0.49) CAPN1KEAP1STAT3SLC6A2CALCRL
SCHEMBL26186082 0.87 KEAP1 (0.49) CAPN1KEAP1STAT3SLC6A2CALCRL
SCHEMBL30585207 0.87 CALCRL (0.46) CAPN1STAT3SLC6A2CALCRLNTSR2
SCHEMBL8625474 0.85 CAPN1 (0.53) CAPN1SLC6A2CALCRLNTSR2NTSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4448561-A2 COMPOSITIONS AND METHODS FOR TREATING DISEASE Dana-Farber Cancer Institute, Inc. (US) 2024-10-23 — — EP claimed
CN-117343197-A Recombinant fusion antibodies 中山大学 2024-01-05 — — CN claimed
WO-2023114847-A2 COMPOSITIONS AND METHODS FOR TREATING DISEASE DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-06-22 — — WO claimed
CN-115975039-A Recombinant fusion antibodies and antibody-drug conjugates and uses thereof 中山大学 2023-04-18 — — CN claimed
CN-114931651-B Targeting-drug based on antibody IgG1-Fc structural domain, and preparation method and application thereof 武汉大学 2025-03-04 — — CN disclosed
CN-116042766-B Composition, method and application for measuring protein ligase activity based on bioluminescence 同济大学 2025-02-11 — — CN disclosed
CN-114478420-B Multi-specific biological coupling connecting arm and synthesis method thereof 北京大学 2025-02-07 — — CN disclosed
CN-117597451-B Enhanced HMO formation by modifying intracellular lactose import 帝斯曼知识产权资产管理有限公司 2024-12-24 — — CN disclosed
CN-113811317-B Mutant VSV ectodomain polypeptides and uses thereof 国家科学研究中心 2024-12-20 — — CN disclosed
CN-113646325-B Peptides and compounds binding to extension initiation factor 4E 新加坡科技研究局 2024-11-15 — — CN disclosed
CN-118974251-A Conjugate of nucleic acid or derivative thereof and cell, preparation method and application thereof 西湖大学 2024-11-15 — — CN disclosed
CN-116286562-B Genetically engineered bacterium and preparation method and application thereof 虹摹生物科技(上海)有限公司 2024-09-10 — — CN disclosed
CN-114573714-A Conjugate for target molecule modification and preparation method thereof 北京大学 2022-06-03 — — CN disclosed
CN-114573707-A Novel anti-tumor IL-15 fusion protein 北京志道生物科技有限公司 2022-06-03 — — CN disclosed
CN-110913908-B MSLN-targeting trispecific proteins and methods of use 哈普恩治疗公司 2022-05-27 — — CN disclosed
CN-114478420-A Multi-specific biological coupling connecting arm and synthetic method thereof 北京大学 2022-05-13 — — CN disclosed
CN-114341637-A Immunosensor 联邦科学工业研究组织 2022-04-12 — — CN disclosed
CN-114269908-A Engineered trans-enoyl COA reductase and preparation method and using method thereof 基因组股份公司 2022-04-01 — — CN disclosed
CN-114173824-A Antibody drug conjugates 武田药品工业株式会社 2022-03-11 — — CN disclosed
CN-114106091-A Protein analogs and conjugates thereof 正大天晴药业集团股份有限公司 2022-03-01 — — CN disclosed
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