SCHEMBL5116638

SCHEMBL5116638

[CH2]CC(=O)N(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
SCHEMBL82112 0.78
SCHEMBL5111424 0.77
SCHEMBL3283077 0.73 ALOX5 (0.45)
SCHEMBL1750672 0.73
SCHEMBL9396873 0.73
SCHEMBL5118135 0.73
SCHEMBL9912431 0.71
SCHEMBL5264334 0.71
SCHEMBL2159354 0.71
SCHEMBL2917865 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054669-B9 USE OF THIADIAZOLO[4,3-A]PYRIDINE DERIVATIVES ROCHE DIAGNOSTICS GMBH (DE) 2004-09-15 EP claimed
EP-1054669-B1 USE OF THIADIAZOLO[4,3-A]PYRIDINE DERIVATIVES ROCHE DIAGNOSTICS GMBH (DE) 2003-07-16 EP claimed
EP-1054669-A2 USE OF THIADIAZOLO[4,3-A]PYRIDINE DERIVATIVES BOEHRINGER MANNHEIM GMBH (DE) 2000-11-29 EP claimed
WO-1999042089-A2 USE OF THIADIAZOLO[4,3-A]PYRIDINE DERIVATIVES ROCHE DIAGNOSTICS GMBH (DE) 1999-08-26 WO claimed
US-7365067-B2 Indanol derivative SANKYO COMPANY, LIMITED (JP) 2008-04-29 US disclosed
US-20070197570-A1 Indanol derivative SANKYO COMPANY, LIMITED (JP) 2007-08-23 US disclosed
EP-1746095-A1 INDANOL DERIVATIVE Sankyo Company, Limited (JP) 2007-01-24 EP disclosed