SCHEMBL8949595

SCHEMBL8949595

CCC(=O)CC[C]=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
SCHEMBL974861 0.84
SCHEMBL9054241 0.81
SCHEMBL6257072 0.80 PTPN7 (0.41)
SCHEMBL8045294 0.80 PTPN7 (0.41)
SCHEMBL5339877 0.80 PTPN7 (0.41)
SCHEMBL9861704 0.76
SCHEMBL8663105 0.76
SCHEMBL580294 0.76 TDP1 (0.45)
SCHEMBL27703598 0.75 KMT2A (0.56)
SCHEMBL619312 0.75 TDP1 (0.69)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3558980-B1 COMPOUNDS FOR USE IN THE TREATMENT OF KINETOPLASTID INFECTION C N C C S S C A R L COLLEZIONE NAZ DEI COMPOSTI CHIMICI E CENTRO SCREENING (IT) 2021-01-27 EP claimed
US-10815222-B2 Compounds for use in the treatment of kinetoplastid infection C.N.C.C.S. S.C.A.R.L. COLLEZIONE NAZIONALE DEI COMPOSTI CHIMICI E CENTRO SCREENING (IT) 2020-10-27 US claimed
US-20200095232-A1 COMPOUNDS FOR USE IN THE TREATMENT OF KINETOPLASTID INFECTION C.N.C.C.S. S.C.A.R.L. COLLEZIONE NAZIONALE DEI COMPOSTI CHIMICI E CENTRO SCREENING (IT) 2020-03-26 US claimed
EP-3558980-A1 COMPOUNDS FOR USE IN THE TREATMENT OF KINETOPLASTID INFECTION C.N.C.C.S. S.c.a.r.l. Collezione Nazionale Dei Composti Chimici e Centro Screening (IT) 2019-10-30 EP claimed
WO-2018115275-A1 COMPOUNDS FOR USE IN THE TREATMENT OF KINETOPLASTID INFECTION IRBM SCIENCE PARK S.P.A. (IT) 2018-06-28 WO claimed
CN-1123547-A Anti-tumor compounds, pharmaceutical compositions, methods for preparation thereof and for treatment UNIV NEW YORK STATE RES FOUND (US) 1996-05-29 CN claimed
US-5480761-A CHROMOGENIC PHOTOGRAPHIC ELEMENTS WITH DIFFUSION TRANSFER EASTMAN KODAK COMPANY (US) 1996-01-02 US claimed
US-5445913-A Mixing spectrally dye-sensitized silver halide emulsion melt and dry diffusion transfer facilitating thermal solvent; coating substrate EASTMAN KODAK COMPANY (US) 1995-08-29 US claimed
WO-2024146512-A1 TRI-SUBSTITUTED PHENYL CYCLOHEXENE THIOETHER COMPOUND AND USE THEREOF 沈阳万菱生物技术有限公司 2024-07-11 WO disclosed
WO-2023210623-A1 HALOALKYL SULFONE ANILIDE COMPOUND AND HERBICIDE CONTAINING SAME 株式会社エス・ディー・エス バイオテック 2023-11-02 WO disclosed
CN-114249640-A Continuous production of methylpentene ketones using cation exchange resins in a fixed bed reactor 印度孟买技术研究院 2022-03-29 CN disclosed
EP-3558980-B1 COMPOUNDS FOR USE IN THE TREATMENT OF KINETOPLASTID INFECTION C N C C S S C A R L COLLEZIONE NAZ DEI COMPOSTI CHIMICI E CENTRO SCREENING (IT) 2021-01-27 EP disclosed
US-10815222-B2 Compounds for use in the treatment of kinetoplastid infection C.N.C.C.S. S.C.A.R.L. COLLEZIONE NAZIONALE DEI COMPOSTI CHIMICI E CENTRO SCREENING (IT) 2020-10-27 US disclosed
CN-111646880-A Separation method for preparing glycol product from synthesis gas 上海浦景化工技术股份有限公司 2020-09-11 CN disclosed
US-5480760-A SULFONAMIDE THERMAL SOLVENT FOR IMPROVED DIFFUSION TRANSFER EASTMAN KODAK COMPANY (US) 1996-01-02 US disclosed
US-5480761-A CHROMOGENIC PHOTOGRAPHIC ELEMENTS WITH DIFFUSION TRANSFER EASTMAN KODAK COMPANY (US) 1996-01-02 US disclosed
US-4561451-A 1,4-Diacylpiperazine flavored smoking compositions PHILIP MORRIS INCORPORATED (US) 1985-12-31 US disclosed
EP-0116640-A4 1,4-DIACYLPIPERAZINE FLAVORED SMOKING COMPOSITIONS. PHILIP MORRIS INC (US) 1984-12-11 EP disclosed
EP-0116640-A1 1,4-DIACYLPIPERAZINE FLAVORED SMOKING COMPOSITIONS PHILIP MORRIS INCORPORATED (US) 1984-08-29 EP disclosed
WO-1984000672-A1 1,4-DIACYLPIPERAZINE FLAVORED SMOKING COMPOSITIONS PHILIP MORRIS INC (US) 1984-03-01 WO disclosed