SCHEMBL6358498

SCHEMBL6358498

COC(=O)OC(C)CC#N

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.36
MCL1 Q07820 2/20 0.32
CTSL P07711 1/20 0.30
CTSB P07858 1/20 0.30
CTSH P09668 1/20 0.30
CTSS P25774 1/20 0.30

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
SCHEMBL3500237 0.80
SCHEMBL21813953 0.79 CTSK (0.41) CTSKMCL1CTSLCTSBCTSH
SCHEMBL23732399 0.78
SCHEMBL28952300 0.78
SCHEMBL966901 0.78 CTSK (0.33) CTSK
SCHEMBL10988177 0.78 MGAM (0.41) CTSKCTSLCTSB
SCHEMBL10325865 0.75 CTSK (0.33) CTSKCTSLCTSB
SCHEMBL23732398 0.75 CTSK (0.41) CTSKCTSLCTSBCTSHCTSS
SCHEMBL4906996 0.74 TSHR (0.42) CTSK
SCHEMBL28321992 0.74 TSHR (0.42) CTSK

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
US-20050123835-A1 Lithium hexafluorophosphate salt, methoxypropionitrile and ethylene carbonate solvents; cobalt lithium oxide cathode, carbon anode; layered separator POLICELL TECHNOLOGIES, INC. 2005-06-09 US claimed
US-20050123835-A1 Lithium hexafluorophosphate salt, methoxypropionitrile and ethylene carbonate solvents; cobalt lithium oxide cathode, carbon anode; layered separator POLICELL TECHNOLOGIES, INC. 2005-06-09 US disclosed