SCHEMBL6686992

SCHEMBL6686992

COc1ccc(N(C(=O)[C@H](CC(C)C)NC(=O)c2cccc(C)c2)[C@H]2CCCNC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 17/20 0.51
CTSS P25774 15/20 0.51
CTSK P43235 11/20 0.51
RPLP1 P05386 2/20 0.40
RPLP0 P05388 2/20 0.40
RPS17 P08708 2/20 0.40
RPSA P08865 2/20 0.40
RPS2 P15880 2/20 0.40
RPL35A P18077 2/20 0.40
RPL7 P18124 2/20 0.40
RPL17 P18621 2/20 0.40
RPS4Y1 P22090 2/20 0.40
RPS3 P23396 2/20 0.40
RPS12 P25398 2/20 0.40
RPL13 P26373 2/20 0.40
RPL10 P27635 2/20 0.40
RPL12 P30050 2/20 0.40
RPL9; RPL9P7; RPL9P8; RPL9P9 P32969 2/20 0.40
RPL22 P35268 2/20 0.40
RPL4 P36578 2/20 0.40

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
SCHEMBL6687577 0.71 CTSL (0.72) CTSLCTSSCTSK
SCHEMBL4795897 0.71 CTSL (0.64) CTSLCTSSCTSK
SCHEMBL4801325 0.71 CTSL (0.64) CTSLCTSSCTSK
SCHEMBL4795900 0.71 CTSL (0.64) CTSLCTSSCTSK
SCHEMBL4795899 0.71 CTSL (0.64) CTSLCTSSCTSK
SCHEMBL25194772 0.70 RPLP1 (0.49) RPLP1RPLP0RPS17RPSARPS2
SCHEMBL4206948 0.69 TAS1R3 (0.75) CTSLCTSSCTSK
SCHEMBL4206947 0.69 TAS1R3 (0.75) CTSLCTSSCTSK
SCHEMBL4801053 0.69 CTSL (0.56) CTSLCTSSCTSK
SCHEMBL4800332 0.69 CTSL (0.56) CTSLCTSSCTSK

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-2004084843-A2 INHIBITORS OF CATHEPSIN S IRM LLC (BM) 2004-10-07 WO disclosed