SCHEMBL29791982

SCHEMBL29791982

[2H]C(C)OC(=O)N(C)N=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL102165 0.82 — —
SCHEMBL7517764 0.69 — —
SCHEMBL16670851 0.67 MAPT (0.31) —
SCHEMBL103015 0.64 — —
SCHEMBL103445 0.64 TSHR (0.40) —
Ethyl Acetate SCHEMBL27881850 0.63 — —
SCHEMBL11306264 0.61 ALDH1A1 (0.44) —
SCHEMBL1044593 0.61 ALDH1A1 (0.44) —
SCHEMBL8382484 0.61 ALDH1A1 (0.42) —
SCHEMBL103096 0.61 BCHE (0.35) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250108091-A1 PROTEIN FORMULATION, PREPARATION METHOD THEREFOR AND USE THEREOF BEIJING LIANGYUAN BIO-SCIENCE, LLC (CN) 2025-04-03 — — US disclosed
CN-111655287-B ILDR2 antagonists and combinations thereof 拜耳股份公司 2024-12-27 — — CN disclosed
EP-4470550-A1 PROTEIN FORMULATION, PREPARATION METHOD THEREFOR AND USE THEREOF Beijing Liangyuan Bio-Science, LLC (CN) 2024-12-04 — — EP disclosed
EP-4460527-A1 MULTISPECIFIC CONSTRUCTS AND USES THEREOF I-Mab Biopharma Co., Ltd. (CN) 2024-11-13 — — EP disclosed
CN-118843468-A Use of hyaluronic acid-nimesulide complexes for the treatment of local late or metastatic tumors 爱禾公司 2024-10-25 — — CN disclosed
CN-118234503-A Protein preparation, preparation method and application thereof 北京良远生物医药研究有限公司 2024-06-21 — — CN disclosed
CN-118217245-A Liposome nano-composition loaded with metformin and 2-deoxy-d-glucan as well as preparation method and application thereof 苏州大学 2024-06-21 — — CN disclosed
CN-113785067-B Chloride-induced prokaryotic expression system 奥瑞丽斯治疗股份公司 2024-01-16 — — CN disclosed
CN-113214287-B HPK1 inhibitors and methods of use thereof 大学健康网络 2023-10-20 — — CN disclosed
CN-116549609-A IL2 preparation, preparation method and application thereof 北京良远生物医药研究有限公司 2023-08-08 — — CN disclosed
WO-2023142559-A1 PROTEIN FORMULATION, PREPARATION METHOD THEREFOR AND USE THEREOF 北京良远生物医药研究有限公司 2023-08-03 — — WO disclosed
WO-2023131329-A1 MULTISPECIFIC CONSTRUCTS AND USES THEREOF I-MAB BIOPHARMA CO., LTD. (CN) 2023-07-13 — — WO disclosed
CN-115867553-A Diaminopyrazolo [1,5-a ] pyrimidine-6-carbonitrile compounds as adenosine 2A receptor and adenosine 2B receptor antagonists 巴格沃克斯研究有限公司 2023-03-28 — — CN disclosed
EP-4121431-A1 DIAMINOPYRAZOLO[1,5-A]PYRIMIDINE-6-CARBONITRILE COMPOUNDS AS ADENOSINE 2A RECEPTOR AND ADENOSINE 2B RECEPTOR ANTAGONIST Bugworks Research, Inc. (US) 2023-01-25 — — EP disclosed
CN-115552009-A Cytokine immunotherapy VLP治疗公司 2022-12-30 — — CN disclosed
CN-110831629-B Combinations comprising ABX196 for the treatment of cancer ABIVAX公司 2022-08-23 — — CN disclosed
WO-2022149167-A1 DIAMINOPYRAZOLO[1,5-A]PYRIMIDINE-6-CARBONITRILE COMPOUNDS AS ADENOSINE 2A RECEPTOR AND ADENOSINE 2B RECEPTOR ANTAGONIST BUGWORKS RESEARCH INDIA PVT LTD (IN) 2022-07-14 — — WO disclosed
Send feedback