SCHEMBL116471

SCHEMBL116471

CC(C)(C)Cl.[MgH2]

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
SCHEMBL10649555 0.93
SCHEMBL7490 0.93
SCHEMBL10416943 0.86
SCHEMBL28645784 0.86
SCHEMBL17698517 0.86
Hydrochloric Acid SCHEMBL8051087 0.86
SCHEMBL5495232 0.86
Ammonia Solution, Strong SCHEMBL662589 0.86
SCHEMBL31367011 0.86
SCHEMBL25284870 0.80

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 1866 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122079874-A Method and device for synthesizing etoricoxib key intermediate MMPE through continuous flow 2026-05-26 CN claimed
EP-4613751-A1 METHOD OF MAKING CHEMICAL COMPOUNDS USEFUL FOR THE SYNTHESIS OF BUPRENORPHINE Siegfried AG (CH) 2025-09-10 EP claimed
CN-120025389-A Phosphoramidate nucleoside drug compound, and synthetic method and drug application thereof 河南师范大学 2025-05-23 CN claimed
CN-119798080-A Preparation method of (R) -5- ([ 1,1' -biphenyl ] -4-yl) -2-methyl-4-oxopentanoic acid calcium salt 杭州科巢生物科技有限公司 2025-04-11 CN claimed
CN-119591769-A Organic polymer carrier, Z-N catalyst, and preparation method and application thereof 中国石油天然气股份有限公司 2025-03-11 CN claimed
CN-119591768-A Organic polymer carrier, Z-N catalyst, and preparation method and application thereof 中国石油天然气股份有限公司 2025-03-11 CN claimed
CN-119591770-A Organic polymer carrier, Z-N catalyst, and preparation method and application thereof 中国石油天然气股份有限公司 2025-03-11 CN claimed
CN-119591771-A Organic polymer carrier, Z-N catalyst, and preparation method and application thereof 中国石油天然气股份有限公司 2025-03-11 CN claimed
CN-119462520-A Preparation method of substituted benzoate derivative 上海皓元医药股份有限公司 2025-02-18 CN claimed
CN-119191963-A Synthesis method of 5-formyl-2, 4-dimethylbenzoic acid 凯美克(上海)医药科技有限公司 2024-12-27 CN claimed
JP-2003521546-A 2003-07-15 JP claimed
EP-1150988-B1 PHOSPHORAMIDATE, AND MONO-, DI-, AND TRI-PHOSPHATE ESTERS OF (1R, CIS)-4-(6-AMINO-9H-PURIN-9-YL)-2-CYCLOPENTENE-1-METHANOL AS ANTIVIRAL AGENTS GLAXO GROUP LTD (GB) 2003-05-28 EP claimed
US-6545165-B1 Cyclization ROCHE COLORADO CORPORATION 2003-04-08 US claimed
CN-1396919-A Synthesis method of 3, 6-dialkyl-5, 6-dihydro-4-hydroxy-pyran-2-ketone HOFFMANN LA ROCHE (CH) 2003-02-12 CN claimed
EP-1255747-A2 SYNTHESIS OF 3,6-DIALKYL-5,6-DIHYDRO-4-HYDROXY-PYRAN-2-ONE F. HOFFMANN-LA ROCHE AG (CH) 2002-11-13 EP claimed
US-6429327-B1 REACTING ORGANOSILANE WITH ALKYLMAGNESIUM HALIDE IN PRESENCE OF MIXED COPPER HALIDE CATALYST; SILANATION, DEHALOGENATION, ALKYLATION, CALALYSIS FMC CORPORATION 2002-08-06 US claimed
EP-1150988-A1 PHOSPHORAMIDATE, AND MONO-, DI-, AND TRI-PHOSPHATE ESTERS OF (1R, CIS)-4-(6-AMINO-9H-PURIN-9-YL)-2-CYCLOPENTENE-1-METHANOL AS ANTIVIRAL AGENTS GLAXO GROUP LIMITED (GB) 2001-11-07 EP claimed
WO-2001057014-A2 SYNTHESIS OF 3,6-DIALKYL-5,6-DIHYDRO-4-HYDROXY-PYRAN-2-ONE F. HOFFMANN-LA ROCHE AG (CH) 2001-08-09 WO claimed
WO-2000047591-A1 PHOSPHORAMIDATE, AND MONO-, DI-, AND TRI-PHOSPHATE ESTERS OF (1R, CIS)-4-(6-AMINO-9H-PURIN-9-YL)-2-CYCLOPENTENE-1-METHANOL AS ANTIVIRAL AGENTS GLAXO GROUP LIMITED (GB) 2000-08-17 WO claimed
US-5886107-A USING TITANIUM CATALYST, ALKALI METAL HYDRIDE SHELL OIL COMPANY (US) 1999-03-23 US claimed