SCHEMBL8801367

SCHEMBL8801367

CCOc1n[nH]c(=O)n1O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.37
MAT2A P31153 1/20 0.32
ALDH1A1 P00352 1/20 0.32
NOTUM Q6P988 1/20 0.32
PDE4D Q08499 1/20 0.31
LMNA P02545 1/20 0.31
BTK Q06187 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL3211179 0.78 NOTUM (0.35) MAT2AALDH1A1NOTUMLMNABTK
SCHEMBL8801537 0.78
SCHEMBL8305450 0.77 ALDH1A1 (0.35) MAT2AALDH1A1NOTUMLMNABTK
SCHEMBL7991493 0.77 ADORA2A (0.33) MAT2ANOTUMPDE4DLMNABTK
SCHEMBL7911441 0.76 MAT2A (0.31) MAT2ANOTUMLMNA
SCHEMBL8801439 0.76 MAT2A (0.31) MAT2ANOTUMLMNA
SCHEMBL6497619 0.75 PDE4A (0.35) ALDH1A1PDE4DLMNA
SCHEMBL9574543 0.69
SCHEMBL9574584 0.66
SCHEMBL8801755 0.64 LMNA (0.33) ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0534266-B1 Sulfonylaminocarbonyltriazolones with two through oxygen bonded substituents BAYER AG (DE) 1997-05-28 EP claimed
EP-0534266-B1 Sulfonylaminocarbonyltriazolones with two through oxygen bonded substituents BAYER AG (DE) 1997-05-28 EP disclosed
US-5554761-A Herbicidal sulphonylaminocarbonyltriazolinones having two substituents bonded via oxygen BAYER AKTIENGESELLSCHAFT (DE) 1996-09-10 US disclosed
US-5488028-A PLANT GROWTH REGULATORS AND ANTIGROWTH AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1996-01-30 US disclosed
US-5300480-A Pre- and postemergent BAYER AKTIENGESELLSCHAFT (DE) 1994-04-05 US disclosed
EP-0534266-A1 Sulfonylaminocarbonyltriazolones with two through oxygen bonded substituents BAYER AG (DE) 1993-03-31 EP disclosed