SCHEMBL7434611

SCHEMBL7434611

CCOC(=O)CNC1(C(=O)OC)CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
GAA P10253 2/20 0.39
MGAM O43451 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
ALDH1A1 P00352 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PPID Q08752 1/20 0.34
EPHX2 P34913 1/20 0.34
MAPK1 P28482 1/20 0.33
NLRP3 Q96P20 1/20 0.33
TRPA1 O75762 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL7445187 0.98 GAA (0.41) MAPTGAAMGAMSIMGAM2
SCHEMBL7435339 0.84 MAPT (0.42) MAPTGAAMGAMSIMGAM2
SCHEMBL7431988 0.79 MAPT (0.40) MAPTALDH1A1L3MBTL1NPSR1CYP4F2
SCHEMBL13744167 0.79 MAPT (0.47) MAPTGAAMGAMSIMGAM2
SCHEMBL5524661 0.79 MAPT (0.47) MAPTALDH1A1L3MBTL1NPSR1CYP4F2
SCHEMBL7432520 0.79 ALDH1A1 (0.32) MAPTGAAMGAMSIMGAM2
SCHEMBL25857186 0.78 GAA (0.43) GAAMGAMSIMGAM2ALDH1A1
Hydrochloric Acid SCHEMBL5524658 0.78 MAPT (0.46) MAPTALDH1A1L3MBTL1NPSR1CYP4F2
SCHEMBL7437999 0.77 MAPT (0.38) MAPTALDH1A1L3MBTL1NPSR1CYP4F2
SCHEMBL7433540 0.77 MEN1 (0.33) MAPTGAAMGAMSIMGAM2

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