SCHEMBL35996

SCHEMBL35996

CC(=O)CCC(C)C

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
SCHEMBL3790342 1.00 CA1 (0.57)
SCHEMBL7541851 1.00
Hydrogen Peroxide SCHEMBL6884370 0.97 CA1 (0.55)
SCHEMBL15091902 0.97
SCHEMBL842034 0.97
Acetic Acid SCHEMBL4601895 0.94 CA1 (0.52)
SCHEMBL8584039 0.92 CA1 (0.50)
Methyl Isobutyl Ketone SCHEMBL8034980 0.89 ALDH1A1 (0.70)
SCHEMBL8334547 0.87 TDP1 (0.48)
SCHEMBL10953164 0.87 ALDH1A1 (0.52)

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 19580 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12595395-B2 Kit-of-parts for curable polyaspartic acid ester-based coating compositions BASF COATINGS GMBH (DE) 2026-04-07 US claimed
US-20260076371-A1 AGROCHEMICAL COMPOSITION OF TRIAZOLES ADAMA MAKHTESHIM LTD. (IL) 2026-03-19 US claimed
US-12578648-B2 Rinsing liquid and pattern forming method FUJIFILM CORPORATION (JP) 2026-03-17 US claimed
US-20260049264-A1 CHEMICAL SOLUTION AND CHEMICAL SOLUTION-HOUSING ARTICLE FUJIFILM CORP (JP) 2026-02-19 US claimed
US-20260026501-A1 AGROCHEMICAL COMPOSITION OF SDHI FUNGICIDES ADAMA MAKHTESHIM LTD. (IL) 2026-01-29 US claimed
US-20260028562-A1 FLAVORED POROUS MATERIAL FOR FLAVORED BEVERAGE PRODUCTION DANSTAR FERMENT AG (CH) 2026-01-29 US claimed
EP-4683974-A1 COATINGS COMPRISING CATIONIC CURING MATERIALS SWIMC LLC (US) 2026-01-28 EP claimed
US-12528768-B2 Crystalline form of a 7H-benzo[7]annulene-2-carboxylic acid derivative SANOFI (FR) 2026-01-20 US claimed
US-12509598-B2 Process solution composition for polymer treatment comprising a fluorine compound, a ketone solvent, and a polar aprotic solvent DONGWOO FINE-CHEM CO., LTD. (KR) 2025-12-30 US claimed
EP-3275039-B1 ELECTROLYTES AND METAL HYDRIDE BATTERIES BASF CORP (US) 2025-08-27 EP claimed
EP-0017396-A1 Hepteno-nitriles, process for their preparation and perfumery compositions containing them BUSH BOAKE ALLEN Limited (GB) 1980-10-15 EP claimed
EP-0014207-A1 EPOXY SURFACER CEMENTS CURED WITH POLYAMINE-KETIMINE MIXTURES AMERON, INC. (US) 1980-08-20 EP claimed
US-4198491-A Process for the production of organic halosilicon acid resinous products and their reaction products BLOUNT DAVID H 1980-04-15 US claimed
EP-0014207-A4 EPOXY SURFACER CEMENTS CURED WITH POLYAMINE-KETIMINE MIXTURES. AMERON INC (US) 1980-03-18 EP claimed
WO-1979000903-A1 EPOXY SURFACER CEMENTS CURED WITH POLYAMINE-KETIMINE MIXTURES AMERON INC (US) 1979-11-15 WO claimed
US-4153764-A Process for the production of polyisocyanate organic silicate solid/cellular solid product BLOUNT DAVID H 1979-05-08 US claimed
US-4148950-A CURING AGENTS AMERON, INC. (US) 1979-04-10 US claimed
US-3981831-A REACTION OF ORGANIC POLYISOCYANATE WITH ALKALI METAL SILICATE OR SILICA SOL BAYER AKTIENGESELLSCHAFT (DT) 1976-09-21 US claimed
US-3956406-A Purification of trimethylolpropane EASTMAN KODAK COMPANY (US) 1976-05-11 US claimed
US-3954397-A LEWIS ACID DYE, 5 OR 6 MEMBERED HETEROCYCLIC TERTIARY AMINE ROHM AND HAAS COMPANY (US) 1976-05-04 US claimed