SCHEMBL13636131

SCHEMBL13636131

CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)CS)C1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 4/20 0.53
CA1 P00915 2/20 0.52
CA2 P00918 2/20 0.52
EPHX1 P07099 1/20 0.51
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49
HDAC4 P56524 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
PARP1 P09874 1/20 0.46
FPR3 P25089 1/20 0.46
FPR2 P25090 1/20 0.46
ANO1 Q5XXA6 2/20 0.45
HPGD P15428 1/20 0.44
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
HSD11B1 P28845 2/20 0.43
CYP2C9 P11712 1/20 0.43
GLS O94925 1/20 0.43

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
SCHEMBL19408900 1.00 USP30 (0.53) USP30CA1CA2EPHX1MEN1
SCHEMBL18959262 1.00 USP30 (0.53) USP30CA1CA2EPHX1MEN1
SCHEMBL25948398 0.87 USP30 (0.55) USP30CA1CA2EPHX1MEN1
SCHEMBL25948405 0.87 USP30 (0.55) USP30CA1CA2EPHX1MEN1
SCHEMBL13636132 0.87 USP30 (0.55) USP30CA1CA2EPHX1MEN1
SCHEMBL23555724 0.85 EPHX1 (0.69) USP30CA1CA2EPHX1MEN1
SCHEMBL3712873 0.84 USP30 (0.50) USP30CA1CA2EPHX1MEN1
SCHEMBL24710621 0.84 USP30 (0.50) USP30CA1CA2EPHX1MEN1
SCHEMBL30919894 0.84 USP30 (0.50) USP30CA1CA2EPHX1MEN1
SCHEMBL23779175 0.83 CA1 (0.57) USP30CA1CA2EPHX1MEN1

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
WO-2009133389-A1 METHODS OF PREPARING SUBSTITUTED HETEROCYCLES ASTRAZENECA AB (SE) 2009-11-05 WO disclosed