SCHEMBL28702168

SCHEMBL28702168

CC(C)(C)OC(=O)NN1CCCCOC1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CTSL P07711 2/20 0.36
CTSB P07858 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CTSD P07339 1/20 0.36
CTSS P25774 1/20 0.36
LIPE Q05469 6/20 0.35
CTSK P43235 3/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 1/20 0.33
RECQL P46063 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 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
SCHEMBL477283 0.87 LIPE (0.42) USP2SMN1; SMN2CTSLCTSBL3MBTL1
SCHEMBL694641 0.85 LIPE (0.44) CTSLCTSBL3MBTL1LIPECTSK
SCHEMBL7365934 0.85 LIPE (0.44) CTSLCTSBL3MBTL1LIPECTSK
SCHEMBL1576452 0.83 CTSK (0.40) USP2SMN1; SMN2CTSLCTSBL3MBTL1
SCHEMBL25724325 0.82 SMN1; SMN2 (0.53) USP2SMN1; SMN2CTSLCTSBCTSD
SCHEMBL1430236 0.73 LIPE (0.36) CTSLCTSBL3MBTL1CTSDCTSS
SCHEMBL7151133 0.73 GNAI3 (0.38) CTSLCTSBL3MBTL1LIPECTSK
SCHEMBL27760998 0.72 EPHX1 (0.38) SMN1; SMN2CTSLCTSBL3MBTL1LIPE
SCHEMBL5190250 0.72 USP2 (0.59) USP2SMN1; SMN2CTSKMEN1MAPT
SCHEMBL5651167 0.72 LIPE (0.39) CTSLCTSBL3MBTL1LIPECTSK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114437105-A Inhibitors of receptor interacting protein kinase 1 戴纳立制药公司 2022-05-06 CN disclosed
CN-109071504-B Inhibitors of receptor interacting protein kinase 1 戴纳立制药公司 2022-03-08 CN disclosed