Hexanoate

Hexanoate

SCHEMBL3178612

CCCCCC(=O)O.[Pd]

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

⚠ 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
Stearic Acid SCHEMBL2837009 0.97 GPR84 (0.94) —
Heptanoate SCHEMBL11895282 0.97 GPR84 (0.94) —
Octanoic Acid SCHEMBL3180463 0.97 GPR84 (0.94) —
Decanoic Acid SCHEMBL4267039 0.97 GPR84 (0.94) —
Behenic Acid SCHEMBL4352628 0.97 GPR84 (0.94) —
Dodecanoate SCHEMBL3180390 0.97 GPR84 (0.94) —
Myristic Acid SCHEMBL3768969 0.97 GPR84 (0.94) —
Pentadecanoic Acid SCHEMBL11895041 0.97 GPR84 (0.94) —
Palmitic Acid SCHEMBL7063777 0.97 GPR84 (0.94) —
Hexanoate SCHEMBL1332504 0.97 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5280001-A Palladium salt, metal persulfate, tin and other metal salt in carboxylic acid PHILLIPS PETROLEUM COMPANY (US) 1994-01-18 — — US claimed
US-5183931-A Catalyzing with carboxylic acid medium in presence of palladium salt, metal persulfate, metal salt and tin salt PHILLIPS PETROLEUM COMPANY (US) 1993-02-02 — — US claimed
WO-2024121084-A1 PREPARATION OF NITRILES MERCK PATENT GMBH (DE) 2024-06-13 — — WO disclosed
CN-106278867-A A kind of preparation method and applications containing fluorocarbon chain palladium catalyst 巨化集团技术中心 2017-01-04 — — CN disclosed
CN-102869698-B The polymkeric substance prepared by renewable resources BASF SE (DE) 2015-11-25 — — CN disclosed
US-9096715-B2 Polymers made of renewable resources BASF SE (DE) 2015-08-04 — — US disclosed
US-20130030075-A1 POLYMERS MADE OF RENEWABLE RESOURCES BASF SE (DE) 2013-01-31 — — US disclosed
CN-102869698-A Polymers made of renewable resources BASF SE 2013-01-09 — — CN disclosed
US-8084563-B2 Cyclic olefin addition copolymer, process for production thereof, and retardation film obtained from the copolymer JSR CORPORATION (JP) 2011-12-27 — — US disclosed
US-20100021707-A1 CYCLIC OLEFIN ADDITION COPOLYMER, METHOD FOR PRODUCING THE SAME, AND RETARDATION FILM OBTAINED FROM THE COPOLYMER JSR CORPORATION (JP) 2010-01-28 — — US disclosed
CN-101484485-A Cyclic olefin addition copolymer, method for producing the same, and retardation film obtained from the copolymer JSR CORP (JP) 2009-07-15 — — CN disclosed
US-4855399-A Carbon monoxide/olefin co-polymerization process with phosphino substituted sulfonic acid catalyst SHELL OIL COMPANY (US) 1989-08-08 — — US disclosed
US-4820802-A Improved process of preparing carbon monoxide/olefin copolymer with ortho substituted phosphine catalyst composition. SHELL OIL COMPANY (US) 1989-04-11 — — US disclosed
US-4818811-A Terpolymer of carbon monoxide and ethylenically unsaturated monomers SHELL OIL COMPANY (US) 1989-04-04 — — US disclosed
US-4810774-A CARBON MONOXIDE SHELL OIL COMPANY (US) 1989-03-07 — — US disclosed
US-4804739-A Process for preparing carbon monoxide polymer with quaternary phosphonium compound bidentate ligand SHELL OIL COMPANY (US) 1989-02-14 — — US disclosed
US-4794165-A Carbon monoxide/olefin polymerization with bidentate ligand containing SHELL OIL COMPANY (US) 1988-12-27 — — US disclosed
US-4469714-A Composition for bonding electroconductive metal coating to electrically nonconductive material OKUNO CHEMICAL INDUSTRY CO., LTD. (JP) 1984-09-04 — — US disclosed
US-4176085-A SOLID PI-ALLYL COMPEXES COMPRISING A PALLADIUM SOURCE, A MONOTERTIARY PHOSPHINE, A REDUCING AGENT, A LEWIS ACID, AND A SILICA-BASED SUPPORT ATLANTIC RICHFIELD COMPANY (US) 1979-11-27 — — US disclosed
US-3936473-A COPPER OR NOBLE METAL SALT, OXYGEN AND ORGANIC ACID CATALYST UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-02-03 — — US disclosed
Send feedback