SCHEMBL691901

SCHEMBL691901

[CH2]C(OCC)(OCC)OCC

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
SCHEMBL847849 0.83 ALDH1A1 (0.32)
SCHEMBL10646386 0.81 ADRB2 (0.36)
SCHEMBL5073591 0.81 ADRB2 (0.36)
SCHEMBL9509371 0.77
SCHEMBL7894728 0.76 TDP1 (0.39)
SCHEMBL128926 0.74
SCHEMBL6547844 0.74
SCHEMBL10441557 0.73 ALDH1A1 (0.40)
SCHEMBL8539819 0.72 ALDH1A1 (0.33)
SCHEMBL2452712 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

Claimed or disclosed in 79 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159923-A1 RIG-I Agonists and Methods of Using Same UNIV YALE (US) 2023-05-25 US claimed
CN-114958050-A Multifunctional coating material, multifunctional film and multifunctional component 江苏日久光电股份有限公司 2022-08-30 CN claimed
US-20110112178-A1 Compositions And Methods For Inhibiting Expression Of IKK-B Gene ALNYLAM PHARMACEUTICALS, INC. (US) 2011-05-12 US claimed
CN-117754859-A Biomedical organosilicon product, preparation method and application thereof 上海苍寻智能科技有限公司 2024-03-26 CN disclosed
US-20240034855-A1 COMPOSITIONS COMPRISING A GRAPHENE-BASED MATERIAL AS LUBRICANT ADDITIVES EVONIK OPERATIONS GMBH (DE) 2024-02-01 US disclosed
EP-3999610-B1 USE OF NANOPARTICLE COMPOSITIONS AS HEAT TRANSFER FLUIDS IN BATTERY OR OTHER ELECTRICAL EQUIPMENT SYSTEMS EVONIK OPERATIONS GMBH (DE) 2023-06-28 EP disclosed
CN-115598753-A Optical film 江苏日久光电股份有限公司(CN) 2023-01-13 CN disclosed
EP-3999610-A1 USE OF NANOPARTICLE COMPOSITIONS AS HEAT TRANSFER FLUIDS IN BATTERY OR OTHER ELECTRICAL EQUIPMENT SYSTEMS Evonik Operations GmbH (DE) 2022-05-25 EP disclosed
EP-3999609-A1 USE OF POLYMERIC-INORGANIC NANOPARTICLE COMPOSITIONS AS HEAT TRANSFER FLUIDS IN BATTERY OR OTHER ELECTRICAL EQUIPMENT SYSTEMS Evonik Operations GmbH (DE) 2022-05-25 EP disclosed
EP-3990595-A1 COMPOSITIONS COMPRISING A GRAPHENE-BASED MATERIAL AS LUBRICANT ADDITIVES Evonik Operations GmbH (DE) 2022-05-04 EP disclosed
EP-3487896-B1 POLYMERIC-INORGANIC PARTICLES USEFUL AS LUBRICANT ADDITIVES EVONIK OPERATIONS GMBH (DE) 2022-04-06 EP disclosed
CN-1636999-A Benzobisazole-base compound MITSUI CHEMICALS INC (JP) 2005-07-13 CN disclosed
US-20050085642-A1 Novel bipyridine derivatives SANKIO CHEMICAL CO., LTD. 2005-04-21 US disclosed
CN-1197067-C Optical recording media and porphinoid compound MITSUI CHEMICALS INC (JP) 2005-04-13 CN disclosed
CN-1575236-A Imide compounds and optical recording media made by using the same MITSUI CHEMICALS INC OGISO AKI (JP) 2005-02-02 CN disclosed
CN-1434771-A Optical recording medium and azaporphyrin compound MITSUI CHEMICALS INC (JP) 2003-08-06 CN disclosed
CN-1406182-A Benzodiazolyl compound, optical recording medium compound MITSUI CHEMICALS INC (JP) 2003-03-26 CN disclosed
CN-1338738-A Optical recording media and porphinoid compound MITSUI CHEMICALS INC (JP) 2002-03-06 CN disclosed
US-5725630-A Dry granular fertilizer blend and a method of fertilizing plants HELENA CHEMICAL CO. 1998-03-10 US disclosed
US-4586368-A Atmospheric pressure helium afterglow discharge detector for gas chromatography THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1986-05-06 US disclosed