SCHEMBL2511084

SCHEMBL2511084

CC1=C(C)C(C)CC1=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
SCHEMBL8461901 0.84 CA1 (0.31)
SCHEMBL19141681 0.77 CA1 (0.35)
SCHEMBL3154470 0.76 ACHE (0.36)
SCHEMBL6129249 0.75 L3MBTL1 (0.32)
SCHEMBL24625125 0.74
SCHEMBL15247082 0.74
SCHEMBL7205910 0.74 CA1 (0.41)
SCHEMBL15418422 0.74
SCHEMBL3891520 0.74
SCHEMBL10455081 0.70 ACHE (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109851701-B Dinuclear metallocene catalyst and preparation method and application thereof 万华化学集团股份有限公司 2021-12-14 CN claimed
US-20250360486-A1 Biorefining Method LICELLA PTY LTD (AU) 2025-11-27 US disclosed
US-12409437-B2 Biorefining method LICELLA PTY LTD (AU) 2025-09-09 US disclosed
CN-115335147-B Catalyst, method for producing isobutyraldehyde and methacrolein, method for producing methacrylic acid, and method for producing methacrylic acid ester 三菱化学株式会社 2024-10-01 CN disclosed
EP-3647327-B1 CATALYST COMPOSITION FOR PREPARING ELASTIC COPOLYMER, AND METHOD FOR PREPARING ELASTIC COPOLYMER, WHICH COMPRISES ETHYLENE AND -OLEFIN OR ETHYLENE, -OLEFIN AND UNCONJUGATED DIENE, BY USING SAME KUMHO POLYCHEM CO LTD (KR) 2024-07-31 EP disclosed
US-20240042414-A1 Biorefining Method LICELLA PTY LTD (AU) 2024-02-08 US disclosed
US-11826722-B2 Biorefining method LICELLA PTY LTD (AU) 2023-11-28 US disclosed
US-20230018899-A1 CATALYST, METHOD FOR PRODUCING ISOBUTYL ALDEHYDE AND METHACROLEIN, METHOD FOR PRODUCING METHACRYLIC ACID, AND METHOD FOR PRODUCING METHACRYLIC ACID ESTER MITSUBISHI CHEMICAL CORPORATION (JP) 2023-01-19 US disclosed
CN-115335147-A Catalyst, method for producing isobutyraldehyde and methacrolein, method for producing methacrylic acid, and method for producing methacrylic acid ester 三菱化学株式会社 2022-11-11 CN disclosed
CN-114950539-A Catalyst for producing p-xylene and preparation method and application thereof 山东理工大学 2022-08-30 CN disclosed
WO-2003006473-A1 NOVEL MULTINUCLEAR HALF METALLOCENE CATALYST AND PREPARATION OF STYRENE POLYMER USING THE SAME LG CHEM, LTD. (KR) 2003-01-23 WO disclosed
EP-1250342-A1 BRIDGED METALLOCENE COMPOUNDS AS OLEFIN-POLYMERIZATION CATALYSTS Polimeri Europa S.p.A. (IT) 2002-10-23 EP disclosed
EP-1248806-A1 METALLOCENE CATALYSTS COMPRISING MONOCYCLIC SILOXY SUBSTITUTED CYCLOPENTADIENYL GROUP(S) FOR THE POLYMERISATION OF OLEFINS Borealis Technology Oy (FI) 2002-10-16 EP disclosed
WO-2001053362-A1 METALLOCENE CATALYSTS COMPRISING MONOCYCLIC SILOXY SUBSTITUTED CYCLOPENTADIENYL GROUP(S) FOR THE POLYMERISATION OF OLEFINS BOREALIS TECHNOLOGY OY (FI) 2001-07-26 WO disclosed
WO-2001040238-A1 BRIDGED METALLOCENE COMPOUNDS AS OLEFIN-POLYMERIZATION CATALYSTS POLIMERI EUROPA S.P.A. (IT) 2001-06-07 WO disclosed
EP-0080600-B1 USE OF 2-HYDROXY-3,4,4-TRIMETHYL-CYCLOPENT-2-ENE-1-ONE AS ODORANT INGREDIENT FIRMENICH SA (CH) 1985-06-19 EP disclosed
US-4315032-A ANTITHROMBOGENIC AGENTS, ANTIULCER AGENTS TEITIN LIMITED (JP) 1982-02-09 US disclosed
EP-0019475-A2 Process for preparing adjacently disubstituted ketones, novel prostaglandins E1 and anti-thrombotic compositions containing them TEIJIN LIMITED (JP) 1980-11-26 EP disclosed
US-4139717-A 1,3-Dicarbonyl compounds TEIJIN LIMITED (JP) 1979-02-13 US disclosed
US-4009196-A HYPOTENSIVE AGENTS, BRONCHODILATORS, PROSTAGLANDIN ANALOGS TEIJIN LIMITED (JA) 1977-02-22 US disclosed