SCHEMBL7437449

SCHEMBL7437449

CCOC(=O)CNCC(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTT P42858 1/20 0.42
ALDH1A1 P00352 6/20 0.40
TRPA1 O75762 1/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
KMT2A Q03164 2/20 0.40
CTSK P43235 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
PPID Q08752 2/20 0.39
TSHR P16473 2/20 0.38
POLB P06746 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL783009 0.87 CA2 (0.41) GAAKMT2ACTSKMEN1
SCHEMBL15194399 0.85 ALDH1A1 (0.49) GAAMGAMSIMGAM2CYP1A2
SCHEMBL753960 0.85 ALDH1A1 (0.46) GAAMGAMSIMGAM2CYP1A2
SCHEMBL391332 0.85 GAA (0.65) GAAMGAMSIMGAM2CYP1A2
SCHEMBL398900 0.84 CA12 (0.46) GAAMGAMSIMGAM2CYP1A2
SCHEMBL7428662 0.83 GAA (0.47) GAAMGAMSIMGAM2CYP1A2
Hydrochloric Acid SCHEMBL27917473 0.83 GAA (0.62) GAAMGAMSIMGAM2CYP1A2
SCHEMBL28234269 0.83 GAA (0.62) GAAMGAMSIMGAM2CYP1A2
SCHEMBL15488645 0.82 PTPRC (0.35) GAAMAPT
SCHEMBL223549 0.81 GAA (0.68) GAAMGAMSIMGAM2CYP1A2

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