SCHEMBL7437685

SCHEMBL7437685

CCOC(=O)CC(C)(C)N(C)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.50
HSD11B1 P28845 1/20 0.48
POLB P06746 1/20 0.45
PPID Q08752 1/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
PIN1 Q13526 1/20 0.40

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
SCHEMBL9304780 0.82 ALDH1A1 (0.47) SMN1; SMN2HSD11B1POLBPPIDALDH1A1
SCHEMBL7440372 0.80 LMNA (0.48) SMN1; SMN2HSD11B1POLBALDH1A1MEN1
SCHEMBL12913142 0.74 PIN1 (0.45) SMN1; SMN2POLBALDH1A1MEN1KMT2A
SCHEMBL28339016 0.74 SMN1; SMN2 (0.46) SMN1; SMN2POLBPPIDALDH1A1MEN1
SCHEMBL557889 0.73 SMN1; SMN2 (0.55) SMN1; SMN2PPIDALDH1A1MEN1KMT2A
SCHEMBL5972547 0.73 CYP2C19 (0.61) SMN1; SMN2HSD11B1POLBPPIDALDH1A1
SCHEMBL21447568 0.73 HSD11B1 (0.52) SMN1; SMN2HSD11B1POLBPPIDALDH1A1
SCHEMBL8079696 0.73 HSD11B1 (0.52) SMN1; SMN2HSD11B1POLBPPIDALDH1A1
SCHEMBL8472209 0.72 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL313012 0.72 POLB (0.55) SMN1; SMN2HSD11B1POLBPPIDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640594-A1 Hydantoin derivative as metalloprotease inhibitor FUJIREBIO INC. (JP) 1995-03-01 EP disclosed