SCHEMBL9856561

SCHEMBL9856561

C=C(O)CNC(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
SCHEMBL21962412 0.82
SCHEMBL447995 0.80
SCHEMBL17636827 0.80 KDM4E (0.43)
SCHEMBL366331 0.79 TGFBR1 (0.42)
SCHEMBL4732711 0.79 KDM4E (0.39)
Aceturic Acid SCHEMBL28850599 0.78 CTH (0.48)
SCHEMBL24353061 0.77 RECQL (0.31)
Acetic Acid SCHEMBL4243346 0.77 KDM4E (0.46)
SCHEMBL6544587 0.77
Aceturic Acid SCHEMBL42918 0.77 CTH (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

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0421146-A2 Drying agent for painted surfaces DURSOL-FABRIK, Otto Durst GmbH &amp; Co. KG (DE) 1991-04-10 EP claimed
EP-0421146-A2 Drying agent for painted surfaces DURSOL-FABRIK, Otto Durst GmbH &amp; Co. KG (DE) 1991-04-10 EP disclosed
US-4186207-A Stable aqueous or aqueous-alcoholic solutions of fat-soluble perfume oils or drugs containing N-(hydroxyalkyl)amide-ethoxylates HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN 1980-01-29 US disclosed
US-4170655-A Stable aqueous or aqueous-alcoholic solutions of fat-soluble perfume oils or drugs containing hydroxyalkyl ester- or N-(hydroxyalkyl) amide-ethoxylates HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1979-10-09 US disclosed