SCHEMBL7445702

SCHEMBL7445702

CC(C)(C)CN1CC(=O)N(C(S)CCc2ccccc2)C1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.40
POLB P06746 1/20 0.38
ENPP2 Q13822 2/20 0.36
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
HSD17B2 P37059 1/20 0.34
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TSHR P16473 1/20 0.32
MCL1 Q07820 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL7432645 0.84 ENPP2 (0.47) POLBENPP2MEN1USP2GAA
SCHEMBL7428792 0.81 CYP2D6 (0.45) POLBENPP2KMT2ANPSR1
SCHEMBL7428456 0.81 PLA2G10 (0.45) POLBENPP2NPSR1HSD17B2KDM4E
SCHEMBL7435811 0.81 ACHE (0.41) ACHEPOLBENPP2MEN1USP2
SCHEMBL7426522 0.79 MAPT (0.43) ACHEPOLBENPP2MEN1USP2
SCHEMBL7440468 0.79 POLB (0.37) POLBMEN1USP2GAAMAPT
SCHEMBL7445692 0.78 ENPP2 (0.36) ACHEPOLBENPP2MEN1KMT2A
SCHEMBL7436003 0.77 HDAC6 (0.42) POLBENPP2MEN1USP2GAA
SCHEMBL7440735 0.76 L3MBTL1 (0.42) ENPP2MEN1GAAKMT2AL3MBTL1
SCHEMBL7435831 0.75 ACHE (0.40) ACHEPOLBMEN1USP2GAA

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