SCHEMBL28811691

SCHEMBL28811691

CCCC(OCC(C)C)(OCC(C)C)OCC(C)C

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
SCHEMBL14778567 0.79
SCHEMBL28812268 0.78 ALDH1A1 (0.32)
SCHEMBL14779669 0.77 MAPK1 (0.32)
SCHEMBL14778185 0.75
SCHEMBL28982588 0.75 ALDH1A1 (0.32)
SCHEMBL28276847 0.75 MAPK1 (0.31)
SCHEMBL11303039 0.73 ALDH1A1 (0.36)
SCHEMBL10482216 0.73 TSHR (0.34)
SCHEMBL14777520 0.72
SCHEMBL28173577 0.71

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-119613414-A Non-azolanet Process for the preparation of tam 上海皓元医药股份有限公司 2025-03-14 CN claimed
US-12059467-B2 Low-toxicity and high-efficiency orthoester mixture pharmaceutical adjuvant, preparation method thereof, and topical sustained release drug delivery formulation including same ANHUI UNIVERSITY (CN) 2024-08-13 US claimed
US-20240108728-A1 IMPROVED LOW-TOXICITY AND HIGH-EFFICIENCY ORTHOESTER MIXTURE PHARMACEUTICAL ADJUVANT, PREPARATION METHOD THEREOF, AND TOPICAL SUSTAINED RELEASE DRUG DELIVERY FORMULATION INCLUDING SAME ANHUI UNIVERSITY (CN) 2024-04-04 US claimed
WO-2023221320-A1 IMPROVED LOW-TOXICITY AND HIGHLY EFFICIENT PHARMACEUTICAL EXCIPIENT OF ORTHOESTER MIXTURE, METHOD FOR PREPARING SAME, AND LOCAL SUSTAINED-RELEASE PREPARATION COMPRISING SAME 安徽大学 2023-11-23 WO claimed
CN-114848585-A Improved low-toxicity high-efficiency orthoester miscible medicine pharmaceutic adjuvant, preparation method and local sustained-release administration preparation containing adjuvant 安徽大学 2022-08-05 CN claimed
CN-119613414-A Non-azolanet Process for the preparation of tam 上海皓元医药股份有限公司 2025-03-14 CN disclosed
WO-2023221320-A1 IMPROVED LOW-TOXICITY AND HIGHLY EFFICIENT PHARMACEUTICAL EXCIPIENT OF ORTHOESTER MIXTURE, METHOD FOR PREPARING SAME, AND LOCAL SUSTAINED-RELEASE PREPARATION COMPRISING SAME 安徽大学 2023-11-23 WO disclosed
CN-114848585-A Improved low-toxicity high-efficiency orthoester miscible medicine pharmaceutic adjuvant, preparation method and local sustained-release administration preparation containing adjuvant 安徽大学 2022-08-05 CN disclosed