SCHEMBL8744936

SCHEMBL8744936

O=C(O)C[C@@](C(=O)O)(N1C(=O)CCC1=O)S(=O)(=O)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
SCHEMBL859389 1.00
SCHEMBL9008981 1.00
Ethylene Glycol SCHEMBL4563857 0.95
Ethylene Glycol SCHEMBL243462 0.95
Di(Hydroxyethyl)Ether SCHEMBL3474303 0.89
SCHEMBL610721 0.83
SCHEMBL166391 0.83
SCHEMBL26623696 0.83 LMNA (0.33)
SCHEMBL44055 0.81
SCHEMBL5497015 0.81

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0596197-B1 Lubricating composition comprising an N-acyl-N-hydrocarbon- oxyalkyl aspartic acid compound KING INDUSTRIES INC (US) 1997-01-29 EP disclosed
EP-0596197-A1 Lubricating composition comprising an N-acyl-N-hydrocarbon- oxyalkyl aspartic acid compound KING INDUSTRIES, INC. (US) 1994-05-11 EP disclosed
US-5275749-A Lubricants with corrosion inhibitors KING INDUSTRIES, INC. (US) 1994-01-04 US disclosed