SCHEMBL8160077

SCHEMBL8160077

CCOC(=O)[C@H]1NCC(=S)C1C(=O)CC1Cc2ccccc2C1=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 4/20 0.39
MAPT P10636 3/20 0.38
MAPK1 P28482 1/20 0.38
ATM Q13315 1/20 0.38
ACHE P22303 4/20 0.36
GAA P10253 3/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LMNA P02545 3/20 0.35
TSHR P16473 1/20 0.35
CYP19A1 P11511 1/20 0.34
MPI P34949 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL8153727 0.85 METAP1 (0.40) METAP1ACHEALDH1A1CYP19A1SMN1; SMN2
SCHEMBL7302832 0.83 GAA (0.38) MAPTMAPK1GAAALDH1A1KDM4E
SCHEMBL8745482 0.80 METAP1 (0.44) METAP1ACHECYP19A1
SCHEMBL7296622 0.80 GAA (0.36) MAPK1GAAALDH1A1KDM4EHSD17B10
SCHEMBL7305086 0.79 ADRA1D (0.39) MAPK1GAAKDM4EHSD17B10
SCHEMBL7302057 0.79 ADRA1D (0.39) MAPK1GAAKDM4EHSD17B10
SCHEMBL7296333 0.79 ADRA1D (0.39) MAPK1GAAKDM4EHSD17B10
SCHEMBL8160593 0.76 PREP (0.40) METAP1ACHE
SCHEMBL7737589 0.74 METAP1 (0.52) METAP1MAPTMAPK1ATMACHE
SCHEMBL7303125 0.73 PREP (0.35) MAPK1ACHEALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6017929-A Cholinesterase activator ZERIA PHARMACEUTICAL CO., LTD. (JP) 2000-01-25 US disclosed
EP-0754454-A1 CHOLINESTERASE ACTIVATOR ZERIA PHARMACEUTICAL CO., LTD. (JP) 1997-01-22 EP disclosed