SCHEMBL570626

SCHEMBL570626

CS(=O)(=O)CC=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
SCHEMBL2791433 0.74 KDM4E (0.36)
SCHEMBL2791430 0.74 KDM4E (0.36)
SCHEMBL1187503 0.71
SCHEMBL110898 0.69
SCHEMBL10399715 0.69
SCHEMBL92901 0.69
SCHEMBL5753306 0.69
SCHEMBL16416853 0.69
SCHEMBL92928 0.67
SCHEMBL1484545 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12145923-B2 Tetrahydroisoquinoline compound, preparation method therefor, pharmaceutical composition containing same, and use thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2024-11-19 US claimed
CN-118851979-A Preparation method of apremilast 潍坊市海欣药业有限公司 2024-10-29 CN claimed
CN-115894310-A Novel preparation method of apremilast chiral amine intermediate 江苏正大清江制药有限公司 2023-04-04 CN claimed
EP-3856342-A1 BICYCLIC DERIVATIVES AS GABAA A5 RECEPTOR MODULATORS Richter Gedeon Nyrt. (HU) 2021-08-04 EP claimed
WO-2020065597-A1 BICYCLIC DERIVATIVES AS GABAA Α5 RECEPTOR MODULATORS RICHTER GEDEON NYRT. (HU) 2020-04-02 WO claimed
EP-2683723-A1 SPIROCYCLIC ISOXAZOLINE DERIVATIVES AS ANTIPARASITIC AGENTS Zoetis LLC (US) 2014-01-15 EP claimed
WO-2012120399-A1 SPIROCYCLIC ISOXAZOLINE DERIVATIVES AS ANTIPARASITIC AGENTS PFIZER INC. (US) 2012-09-13 WO claimed
US-20100278767-A1 Lightening Agents and/or Dyes that Contain Aldehyde(s) HENKEL AG & CO. KGAA (DE) 2010-11-04 US claimed
EP-2051689-A1 LIGHTENING AGENTS AND/OR DYES THAT CONTAIN ALDEHYDE(S) Henkel AG & Co. KGaA (DE) 2009-04-29 EP claimed
EP-2041139-A2 PHARMACEUTICAL COMPOUNDS F.HOFFMANN-LA ROCHE AG (CH) 2009-04-01 EP claimed
WO-2008019986-A1 LIGHTENING AGENTS AND/OR DYES THAT CONTAIN ALDEHYDE(S) HENKEL AG & CO. KGAA (DE) 2008-02-21 WO claimed
WO-2007127175-A2 PHARMACEUTICAL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2007-11-08 WO claimed
US-20060094710-A1 Piperidine-pyridazones and phthalazones as pde4 inhibitors ALTANA PHARMA AG (DE) 2006-05-04 US claimed
EP-1556049-A1 PIPERIDINE-PYRIDAZONES AND PHTHALAZONES AS PDE4 INHIBITORS ALTANA Pharma AG (DE) 2005-07-27 EP claimed
WO-2004017974-A1 PIPERIDINE-PYRIDAZONES AND PHTHALAZONES AS PDE4 INHIBITORS ALTANA PHARMA AG (DE) 2004-03-04 WO claimed
WO-2026087677-A1 ENANTIOSELECTIVE SYNTHESIS OF (S)-AFOXOLANER AND SOLID FORMS OF (S)-AFOXOLANER KRKA, D.D., NOVO MESTO (SI) 2026-04-30 WO disclosed
EP-4580627-A1 TREATMENT OF FASCIOLOSIS Intervet International B.V. (NL) 2025-07-09 EP disclosed
EP-1481972-A1 CYCLIC COMPOUND, PROCESS FOR PRODUCING THE SAME, AND PEST CONTROL AGENT Sumitomo Chemical Takeda Agro Company, Limited (JP) 2004-12-01 EP disclosed
WO-2004017974-A1 PIPERIDINE-PYRIDAZONES AND PHTHALAZONES AS PDE4 INHIBITORS ALTANA PHARMA AG (DE) 2004-03-04 WO disclosed
US-4355184-A BY REACTING AN ALDEHYDE WITH AN ALKALI METAL SALT OF ACETOACETIC NIPPON SODA COMPANY LIMITED (JP) 1982-10-19 US disclosed