SCHEMBL8768226

SCHEMBL8768226

CCOC(=O)ONN=C(NC)OC

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
SOAT1 P35610 1/20 0.39
MAPT P10636 1/20 0.37
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ALOX15 P16050 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
SCHEMBL8768669 0.85 ALDH1A1 (0.38) ALDH1A1SOAT1MAPTMGAMGAA
SCHEMBL8391154 0.76 ALDH1A1 (0.43) ALDH1A1SOAT1MAPTMGAMGAA
SCHEMBL8849951 0.74 RAB9A (0.41) ALDH1A1MAPTMGAMGAASI
SCHEMBL11019424 0.69
SCHEMBL8393558 0.69 ALDH1A1 (0.39) ALDH1A1SOAT1MAPTMGAMGAA
Hydrochloric Acid SCHEMBL6382870 0.68
SCHEMBL7388385 0.67 ALDH1A1 (0.63) ALDH1A1SOAT1MAPTMGAMGAA
SCHEMBL42250 0.66
Dimethylamine SCHEMBL7800983 0.66 ALDH1A1 (0.81) ALDH1A1SOAT1MAPTMGAMGAA
SCHEMBL12489462 0.66 ALDH1A1 (0.71) ALDH1A1SOAT1MAPTMGAMGAA

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-0703224-B1 Process for the preparation of alkoxytriazolinones BAYER AG (DE) 1997-09-03 EP disclosed
EP-0703225-B1 Process for the preparation of alkoxytriazolinones BAYER AG (DE) 1997-09-03 EP disclosed
EP-0703224-A1 Process for the preparation of alkoxytriazolinones BAYER AG (DE) 1996-03-27 EP disclosed
EP-0703225-A1 Process for the preparation of alkoxytriazolinones BAYER AG (DE) 1996-03-27 EP disclosed