SCHEMBL21884

SCHEMBL21884

CC(C)(C)CC=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
SCHEMBL21494503 0.96
SCHEMBL6544163 0.77
Biphenyl SCHEMBL27656696 0.77 ALDH1A1 (0.41)
SCHEMBL28216813 0.77 ALDH1A1 (0.39)
SCHEMBL27841960 0.72 ALDH1A1 (0.36)
SCHEMBL5045799 0.72
SCHEMBL3487755 0.72
SCHEMBL7391212 0.72
SCHEMBL318444 0.72
SCHEMBL5617926 0.72

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

Appears in 5774 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12570650-B2 6-substituted pyridazine compounds as SMARCA2 and/or SMARCA4 degraders AURIGENE ONCOLOGY LIMITED (IN) 2026-03-10 US claimed
EP-4624043-A1 HYDROGENATION CATALYST Hanwha Solutions Corporation (KR) 2025-10-01 EP claimed
EP-4572761-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS Mironid Limited (GB) 2025-06-25 EP claimed
CN-119595902-B Biosensor preparation method for detecting 2-methyl isoborneol 中国科学院生态环境研究中心 2025-06-17 CN claimed
US-12297158-B2 Process for producing compounds, including triptane by an alcohol coupling reaction Petróleo Brasileiro S.A.—Petrobras (BR) 2025-05-13 US claimed
CN-119595902-A Biosensor preparation method for detecting 2-methyl isoborneol 中国科学院生态环境研究中心 2025-03-11 CN claimed
CN-222274423-U Neotame production system 宁夏万香源生物科技有限公司 2024-12-31 CN claimed
CN-118388587-A Production method for improving quality of neotame 宁夏万香源生物科技有限公司 2024-07-26 CN claimed
WO-2024144329-A1 HYDROGENATION CATALYST 한화솔루션 주식회사 2024-07-04 WO claimed
CN-115448924-B Use of nucleoside analogues or combination formulations containing nucleoside analogues in antiviral therapy 中国科学院上海药物研究所 2024-06-18 CN claimed
WO-1993000359-A1 MODIFIED PEPTIDES TRANSPORTABLE INTO THE CENTRAL NERVOUS SYSTEM THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-01-07 WO claimed
US-5140011-A Hypotensive agents HOFFMANN-LA ROCHE, INC. (US) 1992-08-18 US claimed
EP-0443560-A2 HIV protease inhibitors BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1991-08-28 EP claimed
EP-0443573-A2 HIV protease inhibitors containing derived amino acids BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1991-08-28 EP claimed
EP-0391179-A2 Peptide derivatives of amino acids having a renin-inhibiting effect F. HOFFMANN-LA ROCHE AG (CH) 1990-10-10 EP claimed
EP-0391180-A2 Peptide derivatives of amino acids having a renin-inhibiting effect F. HOFFMANN-LA ROCHE AG (CH) 1990-10-10 EP claimed
EP-0389898-A2 Peptide derivatives of amino acids having a renin-inhibiting effect F. HOFFMANN-LA ROCHE AG (CH) 1990-10-03 EP claimed
US-4829070-A PRODRUG FOR SUSTAINED RELEASE OF DOPAMINE UNIVERSITY OF FLORIDA (US) 1989-05-09 US claimed
US-4727079-A Brain-specific dopaminergic activity involving dihydropyridine carboxamides, dihydroquinoline and isoquinoline carboxamides UNIVERSITY OF FLORIDA (US) 1988-02-23 US claimed
EP-0000809-B1 ANTI-INFLAMMATORY 1-PHENYLETHANOLAMINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF AND PROCESSES FOR THEIR MANUFACTURE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-04-14 EP claimed